7008-42-6

• 常用中文名：阿克罗宁
• 常用英文名：7H-Pyrano[2,3-c]acridin-7-one,3,12-dihydro-6-methoxy-3,3,12-trimethyl-
• CAS号：7008-42-6
• 分子式：C₂₀H₁₉NO₃
• 分子量：323.386
• 发布时间：2018-09-24 16:40:29
• 更新时间：2024-01-09 21:04:38

名称

• 中文名: 阿克罗宁
• 英文名: acronycine
• 中文别名: 降真香碱
• 英文别名: Acronina [INN-Spanish]; 6-methoxy-3,3,12-trimethylpyrano[2,3-c]acridin-7-one; Acromycine; 6-methoxy-3,3,12-trimethyl-3,12-dihydro-pyrano[2,3-c]acridin-7-one; 3H-Pyrano[2,3-c]acridin-7-ol, 7,12-dihydro-6-methoxy-3,3,12-trimethyl-; 6-Methoxy-3,3,12-trimethyl-7,12-dihydro-3H-pyrano[2,3-c]acridin-7-ol; 6-Methoxy-3,3,12-trimethyl-3,12-dihydro-pyrano[2,3-c]acridin-7-on; ACRONYCINE; Acronine; Acroninum [INN-Latin]; 4-27-00-03622

物化性质

• 密度: 1.2±0.1 g/cm3
• 沸点: 489.8±45.0 °C at 760 mmHg
• 熔点: 175-176ºC
• 分子式: C₂₀H₁₉NO₃
• 分子量: 323.386
• 闪点: 250.0±28.7 °C
• 精确质量: 323.152130
• PSA: 40.46000
• LogP: 2.99
• 蒸汽压: 0.0±1.3 mmHg at 25°C
• 折射率: 1.612
• 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
• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:0

  3.氢键受体数量:4

  4.可旋转化学键数量:1

  5.互变异构体数量:无

  6.拓扑分子极性表面积:38.8

  7.重原子数量:24

  8.表面电荷:0

  9.复杂度:543

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : UQ0330000 CHEMICAL NAME : 7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6-methoxy-3,3,12-trimethyl- CAS REGISTRY NUMBER : 7008-42-6 BEILSTEIN REFERENCE NO. : 0312954 LAST UPDATED : 199612 DATA ITEMS CITED : 13 MOLECULAR FORMULA : C20-H19-N-O3 MOLECULAR WEIGHT : 321.40 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 522 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 : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 613 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 100 mg/kg TOXIC EFFECTS : Brain and Coverings - recordings from specific areas of CNS Behavioral - somnolence (general depressed activity) TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1170 mg/kg/1Y-I TOXIC EFFECTS : Tumorigenic - Carcinogenic by RTECS criteria Musculoskeletal - tumors TYPE OF TEST : TD - Toxic dose (other than lowest) ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 585 mg/kg/1Y-I TOXIC EFFECTS : Tumorigenic - neoplastic by RTECS criteria Skin and Appendages - tumors TYPE OF TEST : TD - Toxic dose (other than lowest) ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1800 mg/kg/1Y-I TOXIC EFFECTS : Tumorigenic - Carcinogenic by RTECS criteria Tumorigenic - tumors at site of application TYPE OF TEST : TD - Toxic dose (other than lowest) ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 530 mg/kg/8W-I TOXIC EFFECTS : Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors MUTATION DATA TYPE OF TEST : Cytogenetic analysis TEST SYSTEM : Rodent - mouse Fibroblast DOSE/DURATION : 10 mg/L/24H REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 27,1549,1977

合成路线

上下游产品

上游产品  9
13396-93-5 74-88-4 2190-48-9 20324-10-1
79228-40-3 1111-97-3 500-99-2 21421-66-9
79228-37-8
下游产品  5
13161-80-3 70509-94-3 7095-42-3 82791-69-3
52661-35-5