(3Z)-3-Hexen-1-yl acetate

Modify Date: 2024-01-04 19:48:58

(3Z)-3-Hexen-1-yl acetate Structure
(3Z)-3-Hexen-1-yl acetate structure
Common Name (3Z)-3-Hexen-1-yl acetate
CAS Number 3681-71-8 Molecular Weight 142.196
Density 0.9±0.1 g/cm3 Boiling Point 174.2±19.0 °C at 760 mmHg
Molecular Formula C8H14O2 Melting Point N/A
MSDS Chinese USA Flash Point 67.5±19.9 °C
Symbol GHS02
GHS02
Signal Word Warning

 Names

Name (3Z)-hex-3-en-1-yl acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.9±0.1 g/cm3
Boiling Point 174.2±19.0 °C at 760 mmHg
Molecular Formula C8H14O2
Molecular Weight 142.196
Flash Point 67.5±19.9 °C
Exact Mass 142.099380
PSA 1.90580
LogP 2.41
Vapour Pressure 1.2±0.3 mmHg at 25°C
Index of Refraction 1.433

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MP8425050
CHEMICAL NAME :
3-Hexen-1-ol, acetate, (Z)-
CAS REGISTRY NUMBER :
3681-71-8
BEILSTEIN REFERENCE NO. :
1721854
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C8-H14-O2

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 :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,454,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,454,1975 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7452 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 1557 (estimated) No. of Female Employees: 276 (estimated)

 Safety Information

Symbol GHS02
GHS02
Signal Word Warning
Hazard Statements H226
Personal Protective Equipment Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
Hazard Codes T+
Risk Phrases R36/38
Safety Phrases S26-S36
RIDADR UN 3272 3/PG 3
WGK Germany 2
RTECS MP8425050
Packaging Group III
Hazard Class 3
HS Code 2915390090

 Synthetic Route

~%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: FIRMENICH SA Patent: WO2008/120175 A1, 2008 ; Location in patent: Page/Page column 19; 21-22 ;

~10%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Bartoli, Giuseppe; Bosco, Marcella; Dalpozzo, Renato; Marcantoni, Enrico; Massaccesi, Massimo; Sambri, Letizia European Journal of Organic Chemistry, 2003 , # 23 p. 4611 - 4617

~96%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Velusamy, Subbarayan; Borpuzari, Sarbani; Punniyamurthy Tetrahedron, 2005 , vol. 61, # 8 p. 2011 - 2015

~87%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Inoue, Yoshihisa; Goan, Kazuyoshi; Hakushi, Tadao Bulletin of the Chemical Society of Japan, 1985 , vol. 58, # 8 p. 2217 - 2220

~%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Li, Xiaoshuan; Yu, Dinghua; Zhang, Wengui; Li, Zhengwen; Zhang, Xiaowei; Huang, He Applied Catalysis A: General, 2013 , vol. 455, p. 1 - 7

~%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Liaquat, Muhammad; Khan, Saeed; Aslam, Sher; Khan, Ayub; Khan, Hakim; Khan, Shah Masaud; Ali, Sardar; Wahab, Said; Bhatti, Haq Nawaz Journal of the Chemical Society of Pakistan, 2012 , vol. 34, # 1 p. 144 - 150

~%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Matsukawa, Mihaya; Tabuchi, Takanori; Inanaga, Junji; Yamaguchi, Masaru Chemistry Letters, 1987 , p. 2101 - 2102

~%

(3Z)-3-Hexen-1-yl acetate Structure

(3Z)-3-Hexen-1-...

CAS#:3681-71-8

Literature: Bohnsack Chemische Berichte, 1942 , vol. 75, p. 74

 Customs

HS Code 2915390090
Summary 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

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 Synonyms

Leaf Acetate
HEX-3ENYLSALICYLATE
(3Z)-Hex-3-en-1-yl acetate
hexenyl salicylate cis-3
cis-3-Hexenyl acetate
Z-3-hexenyl salicylate
Leaf salicylate
3-hexenylsalicylate
cis-3-hexene-1-ol acetate
Acetic Acid cis-3-Hexenyl Ester
EINECS 222-960-1
MFCD00036563
Cis-Hexenyl Salicylate
cis-3-hexen-1-yl salicylate
C3 HEXENYL SALICYLATE
3-Hexen-1-ol, acetate, (3Z)-
cis-3-hexenyl salkylate
3-Hexen-1-yl salicylate
HEXENYLSALICYLAT CIS-3
(3Z)-3-Hexen-1-ol acetate,(3Z)-C-3-Hexenyl acetate,Leaf acetate
cis-3-Hexen-1-yl acetate
(3Z)-3-Hexen-1-yl acetate
CA14202500 cis-3-Hexenyl
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