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2035-99-6

2035-99-6 structure
2035-99-6 structure
Name 3-methylbutyl octanoate
Synonyms 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
Description Isopentyl octanoate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog
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.)

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
Symbol GHS07
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
123-51-3 structure

123-51-3

124-07-2 structure

124-07-2

~%

2035-99-6 structure

2035-99-6

Literature: Journal of Agricultural and Food Chemistry, , vol. 54, # 7 p. 2695 - 2704
123-51-3 structure

123-51-3

111-64-8 structure

111-64-8

~%

2035-99-6 structure

2035-99-6

Literature: Journal of the Chemical Society, , p. 2416,2418
Precursor  3

DownStream  0

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%
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