Ethyl heptanoate

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Names

[ CAS No. ]:
106-30-9

[ Name ]:
Ethyl heptanoate

[Synonym ]:
Ethyl heptoate
Ethyl heptanoate
Grape oil
Ethylheptanoat
ethyl enanthoate
ethyl n-heptanoate
Oenanthic ether
ethyl oenanthate
Enanthylic ether
Ethyl enanthate
Aether Oenanthieus
Cognac Oil Synthetic
heptanoic acid ethyl ester
Cognac oil
Enanthic Acid Ethyl Ester
EINECS 203-382-9
MFCD00009538
Ethyl n-Heptoate
Aether oenanthicus
Heptanoic acid, ethyl ester
ethyl heptylate
Oil of Grapes

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
188.3±3.0 °C at 760 mmHg

[ Melting Point ]:
−66 °C(lit.)

[ Molecular Formula ]:
C9H18O2

[ Molecular Weight ]:
158.238

[ Flash Point ]:
66.1±0.0 °C

[ Exact Mass ]:
158.130676

[ PSA ]:
26.30000

[ LogP ]:
3.37

[ Vapour Pressure ]:
0.6±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.418

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MJ2087000
CHEMICAL NAME :
Heptanoic acid, ethyl ester
CAS REGISTRY NUMBER :
106-30-9
BEILSTEIN REFERENCE NO. :
1752311
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C9-H18-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 :
>34640 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - coma Skin and Appendages - hair
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 2,327,1964
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: 19,247,1981 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83911 No. of Facilities: 5 (estimated) No. of Industries: 1 No. of Occupations: 3 No. of Employees: 38 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83911 No. of Facilities: 1486 (estimated) No. of Industries: 10 No. of Occupations: 30 No. of Employees: 15729 (estimated) No. of Female Employees: 3573 (estimated)

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S37/39-S26

[ RIDADR ]:
UN 1993 / PGIII

[ WGK Germany ]:
1

[ RTECS ]:
MJ2087000

[ HS Code ]:
29159080

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Ethanol
  • Hexylamine
  • carbon monoxide
  • Ethyl 6-heptenoate
  • ethyl hept-2-enoate
  • EDA
  • Pentane
  • tributylindigane
  • Ethyl acrylate TOP1 supplier
  • n-heptanoic acid

DownStream

  • Heptanamide,N,N-diethyl-
  • Palmitoleic acid
  • 7-tridecanone
  • 8-hydroxytetradecan-7-one
  • 2-oxooctanal
  • Heptanal
  • Heptan-1-ol
  • Ethanol
  • n-heptanoic acid
  • Palmitelaidic acid

Customs

[ HS Code ]: 2915900090

[ Summary ]:
2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

Articles

Effects of droplet crystallization and melting on the aroma release properties of a model oil-in-water emulsion.

J. Agric. Food Chem. 54(5) , 1829-37, (2006)

Aroma compounds partition between the dispersed and the continuous phases in emulsions, and phase transitions in the lipid droplets profoundly affect the position of the equilibrium. In the present st...

Influence of poly (lactide-co-glycolide) type and gamma irradiation on the betamethasone acetate release from the in situ forming systems.

Curr. Drug Deliv. 6(2) , 184-91, (2009)

In situ forming biodegradable polymeric systems were prepared from Poly (DL-lactide-co-glycolide), RG504H (50:50, lactide:glycolide), RG756 (75:25) and mixture of them. They were dissolved in N-methyl...

Identification of electrophysiologically-active compounds for the malaria mosquito, Anopheles gambiae, in human sweat extracts.

Med. Vet. Entomol. 10(3) , 269-76, (1996)

Human sweat samples were chemically fractionated into acid and non-acid components. The most abundant volatile compounds present in the fractions were identified by linked gas chromatography mass spec...


More Articles

Related Compounds

  • acetamide,ethyl heptanoate
  • 1-acetyloxyethyl heptanoate
  • 2-dimethylaminoethyl heptanoate
  • 2-dimethylaminoethyl heptanoate
  • 2-(2-butoxyethoxy)ethyl heptanoate
  • 2-(2-hydroxyethoxy)ethyl heptanoate
  • 1,1-Dimethylethyl 4-(4-bromo-2-chlorobenzoyl)-1-piperazinecarboxylate
  • 2-(1H-1,2,3,4-tetrazol-5-yl)prop-2-en-1-amine
  • [3-(2-Cyclopropylphenyl)-2,2-dimethylcyclopropyl]methanamine
  • 3-(3-Ethynylphenyl)prop-2-en-1-ol
  • [3-(2,4-Dichlorophenyl)-2,2-dimethylcyclopropyl]methanamine
  • 1-(3-Bromopropyl)-2-(propan-2-yl)benzene
  • 3-(4-Amino-1,1-difluoro-2-methylbutan-2-yl)-1-butylurea
  • 3-Amino-3-(2,3,4-trihydroxyphenyl)propanoic acid
  • 2-[4-(Difluoromethoxy)phenyl]-2-methylpropanal
  • (1-Propoxycyclopentyl)methanol
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