氯化苄
氯化苄用途
用作染料中间体及用于单宁、香料、药品等的合成。
氯化苄名称
[ CAS 号 ]:
100-44-7
[ 中文名 ]:
苄基氯
[ 英文名 ]:
Benzyl chloride
[中文别名 ]:
[英文别名 ]:
- Benzene, (chloromethyl)-
- (Chloromethyl)benzene
- phenylmethyl chloride
- MFCD00000889
- Chloromethylbenzene
- toluene, α-chloro-
- Benzyl chloride
- BENZENE, CHLOROMETHYL-
- α-CHLOROTOLUENE
- Tolyl chloride
氯化苄物理化学性质
[ 密度 ]:
1.1±0.1 g/cm3
[ 沸点 ]:
179.4±0.0 °C at 760 mmHg
[ 熔点 ]:
-39 °C
[ 分子式 ]:
C7H7Cl
[ 分子量 ]:
126.584
[ 闪点 ]:
73.9±0.0 °C
[ 精确质量 ]:
126.023628
[ LogP ]:
2.49
[ 外观性状 ]:
无色液体
[ 蒸汽密度 ]:
4.36 (vs air)
[ 蒸汽压 ]:
1.3±0.3 mmHg at 25°C
[ 折射率 ]:
1.527
[ 储存条件 ]:
库房通风低温干燥,与氧化剂、食品添加剂分开存放
[ 水溶解性 ]:
0.3 g/L (20 ºC)
氯化苄MSDS
氯化苄毒性和生态
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XS8925000
- CHEMICAL NAME :
- Toluene, alpha-chloro-
- CAS REGISTRY NUMBER :
- 100-44-7
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 83
- MOLECULAR FORMULA :
- C7-H7-Cl
- MOLECULAR WEIGHT :
- 126.59
- WISWESSER LINE NOTATION :
- G1R
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1231 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 150 ppm/2H
- TOXIC EFFECTS :
- Lungs, Thorax, or Respiration - respiratory depression
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 625 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 80 ppm/2H
- TOXIC EFFECTS :
- Lungs, Thorax, or Respiration - respiratory depression
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 780 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - species unspecified
- DOSE/DURATION :
- 1500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Mammal - species unspecified
- DOSE/DURATION :
- 390 mg/m3
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4836 mg/kg/26W-I
- TOXIC EFFECTS :
- Cardiac - other changes Gastrointestinal - necrotic changes Related to Chronic Data - death
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 7800 mg/kg/26W-I
- TOXIC EFFECTS :
- Liver - other changes
- TYPE OF TEST :
- TCLo - Lowest published toxic concentration
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 46 ppm/6H/14D-I
- TOXIC EFFECTS :
- Sense Organs and Special Senses (Olfaction) - effect, not otherwise specified
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 50 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 31 gm/kg/2Y-I
- TOXIC EFFECTS :
- Tumorigenic - Carcinogenic by RTECS criteria Vascular - tumors Gastrointestinal - tumors
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 9200 mg/kg/50W-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors Skin and Appendages - tumors
- TYPE OF TEST :
- TD - Toxic dose (other than lowest)
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2100 mg/kg/53W-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1 gm/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 11 ug/kg
- SEX/DURATION :
- female 1-19 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetal death
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- DOSE :
- 250 mg/kg
- SEX/DURATION :
- male 5 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 2500 mg/kg
- SEX/DURATION :
- male 5 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count)
MUTATION DATA
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Rodent - hamster Ovary
- REFERENCE :
- JJATDK JAT, Journal of Applied Toxicology. (John Wiley & Sons Ltd., Baffins Lane, Chichester, W. Sussex PO19 1UD, UK) V.1- 1981- Volume(issue)/page/year: 3,203,1983 *** REVIEWS *** ACGIH TLV-Animal carcinogen DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: TLV/BEI,1997 ACGIH TLV-TWA 5.2 mg/m3 (1 ppm) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: TLV/BEI,1997 IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 29,49,1982 IARC Cancer Review:Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 29,49,1982 *** U.S. STANDARDS AND REGULATIONS *** MSHA STANDARD-air:TWA 1 ppm (5 mg/m3) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: 3,24,1971 OSHA PEL (Gen Indu):8H TWA 1 ppm (5 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1910.1000,1994 OSHA PEL (Construc):8H TWA 1 ppm (5 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1926.55,1994 OSHA PEL (Shipyard):8H TWA 1 ppm (5 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1915.1000,1993 OSHA PEL (Fed Cont):8H TWA 1 ppm (5 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 41,50-204.50,1994 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-AUSTRALIA:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-AUSTRIA:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-BELGIUM:TWA 1 ppm (5.2 mg/m3) JAN 1993 OEL-DENMARK:STEL 1 ppm (5 mg/m3) JAN 1993 OEL-DENMARK:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-FINLAND:TWA 1 ppm (5 mg/m3);STEL 3 ppm (15 mg/m3) JAN 1993 OEL-FRANCE:TWA 1 ppm (5 mg/m3);STEL 2 ppm (11 mg/m3);Skin JAN 1993 OEL-FRANCE:TWA 1 ppm (5 mg/m3);STEL 3 ppm (15 mg/m3);Carcinogen JAN 1993 OEL-GERMANY:TWA 1 ppm (5 mg/m3);Carcinogen JAN 1993 OEL-HUNGARY:STEL 0.5 mg/m3;Skin JAN 1993 OEL-THE NETHERLANDS:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-THE PHILIPPINES:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-RUSSIA:STEL 0.5 mg/m3 JAN 1993 OEL-SWEDEN:TWA 1 ppm (5 mg/m3);STEL 2 ppm (11 mg/m3);Carcinogen JAN 1993 OEL-SWITZERLAND:TWA 1 ppm (5 mg/m3);STEL 2 ppm (10 mg/m3) JAN 1993 OEL-TURKEY:TWA 1 ppm (5 mg/m3) JAN 1993 OEL-UNITED KINGDOM:TWA 1 ppm (3 mg/m3);STEL 2 ppm (6 mg/m3) JAN 1993 OEL-UNITED KINGDOM:TWA 1 ppm (5 mg/m3) JAN 1993 OEL IN BULGARIA, COLOMBIA, JORDAN, KOREA check ACGIH TLV OEL IN NEW ZEALAND, SINGAPORE, VIETNAM check ACGIH TLV *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH RECOMMENDED EXPOSURE LEVEL (REL) : NIOSH REL TO BENZYL CHLORIDE-air:CL 1 ppm/15M REFERENCE : NIOSH* National Institute for Occupational Safety and Health, U.S. Dept. of Health, Education, and Welfare, Reports and Memoranda. Volume(issue)/page/year: DHHS #92-100,1992 NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 11600 No. of Facilities: 172 (estimated) No. of Industries: 5 No. of Occupations: 10 No. of Employees: 30504 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 11600 No. of Facilities: 1877 (estimated) No. of Industries: 29 No. of Occupations: 25 No. of Employees: 41075 (estimated) No. of Female Employees: 8440 (estimated)
氯化苄安全信息
[ 符号 ]:
GHS05, GHS06, GHS08
[ 信号词 ]:
Danger
[ 危害声明 ]:
H302-H315-H317-H318-H330-H335-H350-H373
[ 警示性声明 ]:
P201-P260-P280-P304 + P340 + P310-P305 + P351 + P338 + P310
[ 个人防护装备 ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
[ 危害码 (欧洲) ]:
T:Toxic
[ 风险声明 (欧洲) ]:
R22;R23;R37/38;R41;R45;R48/22
[ 安全声明 (欧洲) ]:
S53-S45
[ 危险品运输编码 ]:
UN 1738 6.1/PG 2
[ WGK德国 ]:
3
[ RTECS号 ]:
XS8925000
[ 包装等级 ]:
II
[ 危险类别 ]:
6.1
[ 海关编码 ]:
2903999090
氯化苄合成路线
氯化苄上下游产品
氯化苄上游产品
氯化苄下游产品
氯化苄制备
1.甲苯连续光氯化法 将干燥不含铁质的甲苯加到无铁反应器中,在光照下进行高温氯化。然后分馏氯化产物,即得氯化苄,副产氯化氢用水吸收得盐酸,副产α-二氯甲基苯可经水解作用制成苯甲醛。
2.甲苯无光热氯化法 甲苯先静置6h以上以除去铁质,再经高位槽送入氯化锅中,以蒸气加热至沸腾后停止加热,通入氯气进行氯化,连续反应制得的氯化苄通过底部溢流管冷却后进入贮槽。氯化苄的制备主要由甲苯氯化而得。目前国内外主要有两种方法:光氯化法和无光热氯化法。从工艺操作来分,两种方法又各有间歇操作和连续操作两种。从反应器结构来分,连续操作又可分为水平连续操作和垂直连续操作两种。由于甲苯连续光氯化法具有小批量生产容易上马,反应速度比无光热氯化法快的优点,国内较多厂家采用此工艺。一般采用小型水平串联连续式反应器组。将干燥不含铁质的甲苯加入玻璃氯化瓶中,加热至110℃,使液体缓缓沸腾,按氯气与甲苯质量比为1∶2.5在日光灯照射下通入氯气,于110~120℃进行高温氯化反应至终点。蒸馏回收未反应的甲苯,收集160~180℃馏分即为粗品氯化苄。再经常压分馏,收集176~182℃馏分,即得到氯化苄成品。
甲苯无光热氯化法则一般采用大型垂直连续式搪瓷反应釜。此外,甲苯在催化剂过氧化物存在下与氯化亚硫反应,或在氯化锌催化下苯环氯甲基化等,均可制得氯化苄。
3.制法:
于装有温度计、回流冷凝器(顶部连一氯化钙干燥音,干燥管连接氯化氢和氯气吸收装置)、通气导管的反应瓶中,加入甲苯(2)92g(1.0mol),几粒沸石,油浴加热至沸。用一只200W的灯泡照射①,通入经浓硫酸干燥的氯气(直接通到反应瓶底部),在微沸状态下连续通氯直至瓶内温度升至156℃时,停止通氯。常压蒸馏,先回收未反应的甲苯,再收集165~185℃的馏分。重新蒸馏,收集178~182℃的馏分。得氯化苄(1)①90g,收率70%。注:①也可用日光灯或石英灯照射,该反应为自由基型反应。②也可用甲基在过氧化戊存在下与氯化亚砜反应来制备,或由苯的氯甲基化等反应来制备。
氯化苄海关
[ 海关编码 ]: 2903999090
[ 中文概述 ]:
2903999090 其他芳烃卤化衍生物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
[ 申报要素 ]: 品名, 成分含量, 用途
[ Summary ]:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%
氯化苄文献
Macromol. Biosci. 15 , 965-78, (2015)
A novel gene transfection vector was fabricated based on the conjugation of human serum albumin (HSA) and maleimide end functionalized poly[(N,N-dimethylamino) ethyl methacrylate] (PDMAEMA). The bioco...
Convenient QSAR model for predicting the complexation of structurally diverse compounds with β-cyclodextrinsBioorg. Med. Chem. 17 , 896-904, (2009)
This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoret...
QSAR study and synthesis of new phenyltropanes as ligands of the dopamine transporter (DAT).Bioorg. Med. Chem. 20 , 1388-95, (2012)
The dopamine transporter (DAT) plays a pivotal role in the regulation of dopamine neurotransmission, and is involved in a number of physiological functions and brain disorders. Furthermore the DAT ana...
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相关化合物
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标题:氯化苄_MSDS_用途_密度_氯化苄CAS号【100-44-7】_化源网 地址:https://www.chemsrc.com/amp/cas/100-44-7_752567.html