fema 2080

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Names

[ CAS No. ]:
2035-99-6

[ Name ]:
fema 2080

[Synonym ]:
Isopentyl octylate
n-Octanoic Acid Isoamyl Ester (contains 2-Methylbutyl n-Octanoate)
MFCD00048917
EINECS 218-004-8
Octanoic acid,3-methylbutyl ester
Isopentyl octanoate
Isoamyl octylate
IsoaMyl n-Octanoate (contains 2-Methylbutyl n-Octanoate)
Isopentyl n-Octanoate (contains 2-Methylbutyl n-Octanoate)
Octanoic acid,isopentyl ester
Isoamyl n-Octanoate
Octansaeure-isopentylester
Isoamyl caprylate
Isoamyl octanoate

Chemical & Physical Properties

[ Density]:
0.861 g/mL at 25 °C(lit.)

[ Boiling Point ]:
267-268 °C

[ Molecular Formula ]:
C13H26O2

[ Molecular Weight ]:
214.34400

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
214.19300

[ PSA ]:
26.30000

[ LogP ]:
3.93620

[ Vapour Pressure ]:
0.0236mmHg at 25°C

[ Index of Refraction ]:
n20/D 1.426(lit.)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RH0770000
CHEMICAL NAME :
Octanoic acid, isopentyl ester
CAS REGISTRY NUMBER :
2035-99-6
BEILSTEIN REFERENCE NO. :
1767760
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C13-H26-O2
MOLECULAR WEIGHT :
214.39
WISWESSER LINE NOTATION :
7VO2Y1&1

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: 17,827,1979 ** 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: 17,827,1979
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: 17,827,1979

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
RH0770000

[ HS Code ]:
2915900090

Synthetic Route

Precursor & DownStream

Precursor

  • 3-Methyl-1-butanol
  • Octanoic acid
  • Octanoyl chloride

DownStream

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

Mosciano, G.

Perfum. Flavor. 2nd ed., 24 , 50, (1999)


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