Ethyl caprylate

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Names

[ CAS No. ]:
106-32-1

[ Name ]:
Ethyl caprylate

[Synonym ]:
n-Octanoic Acid Ethyl Ester
Caprylic acid ethyl ester
Ethyl n-Octanoate
EINECS 203-385-5
ethyl octanoate
MFCD00009552
Octanoic acid ethyl ester
Octanoic acid, ethyl ester
Ethyl caprylate

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
207.5±3.0 °C at 760 mmHg

[ Melting Point ]:
-47 °C

[ Molecular Formula ]:
C10H20O2

[ Molecular Weight ]:
172.265

[ Flash Point ]:
75.0±0.0 °C

[ Exact Mass ]:
172.146332

[ PSA ]:
26.30000

[ LogP ]:
3.90

[ Vapour Pressure ]:
0.2±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.423

[ Water Solubility ]:
insoluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RH0680000
CHEMICAL NAME :
Octanoic acid, ethyl ester
CAS REGISTRY NUMBER :
106-32-1
BEILSTEIN REFERENCE NO. :
1754470
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C10-H20-O2
MOLECULAR WEIGHT :
172.30
WISWESSER LINE NOTATION :
7VO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,763,1976 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
25960 mg/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: 14,763,1976 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4667 No. of Facilities: 24 (estimated) No. of Industries: 2 No. of Occupations: 4 No. of Employees: 402 (estimated)

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R38

[ Safety Phrases ]:
S26-S36

[ WGK Germany ]:
2

[ RTECS ]:
RH0680000

[ HS Code ]:
29159080

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-Bromobutane
  • bromo(4-ethoxy-4-oxobutyl)zinc
  • Ethyl 4-bromobutanoate
  • Butylmagnesium chloride
  • Ethanol
  • Octanoic acid
  • Ethyl chloroformate
  • butylzinc bromide
  • Octanal
  • (2E)-2-Nonenal

DownStream

  • 1-methylsulfonylnonan-2-one
  • allyl caprylate
  • 2-Heptyl-1H-benzimidazole
  • N-(2-aminophenyl)octanamide
  • 3,8-dihexyl-1,10-dihydro-1,10-phenanthroline-4,7-dione
  • octene
  • Octanal
  • 1-Octanol
  • 2-Nonanone
  • 2-METHYL-1-NONENE

Customs

[ HS Code ]: 29159080

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