allyl isovalerate

Modify Date: 2025-08-20 12:12:22

allyl isovalerate Structure
allyl isovalerate structure
 Common Name allyl isovalerate
CAS Number 2835-39-4 Molecular Weight 142.19600
Density 0.88 g/mL at 25ºC(lit.) Boiling Point 155ºC(lit.)
Molecular Formula C8H14O2 Melting Point N/A
MSDS Chinese USA Flash Point 139 °F
Symbol GHS02 GHS06
GHS02, GHS06		 Signal Word Danger

 Names

Name prop-2-enyl 3-methylbutanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.88 g/mL at 25ºC(lit.)
Boiling Point 155ºC(lit.)
Molecular Formula C8H14O2
Molecular Weight 142.19600
Flash Point 139 °F
Exact Mass 142.09900
PSA 26.30000
LogP 1.76170
Vapour Pressure 1.95mmHg at 25°C
Index of Refraction n20/D 1.416(lit.)

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NY1412000
CHEMICAL NAME :
Isovaleric acid, allyl ester
CAS REGISTRY NUMBER :
2835-39-4
BEILSTEIN REFERENCE NO. :
1750520
LAST UPDATED :
199710
DATA ITEMS CITED :
17
MOLECULAR FORMULA :
C8-H14-O2
MOLECULAR WEIGHT :
142.22
WISWESSER LINE NOTATION :
1Y1&1VO2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
230 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
560 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
31930 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Blood - leukemia Blood - lymphoma, including Hodgkin's disease
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
31930 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Blood - lymphoma, including Hodgkin's disease
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
15965 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Endocrine - tumors Blood - leukemia

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
500 mg/L
REFERENCE :
SCIEAS Science. (American Assoc. for the Advancement of Science, 1333 H St., NW, Washington, DC 20005) V.1- 1895- Volume(issue)/page/year: 236,933,1987 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 36,69,1985 IARC Cancer Review:Human No Adequate Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 36,69,1985 IARC Cancer Review:Group 3 IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987

 Safety Information

Symbol GHS02 GHS06
GHS02, GHS06
Signal Word Danger
Hazard Statements H226-H301-H311-H315-H319-H335
Precautionary Statements P261-P280-P301 + P310-P305 + P351 + P338-P312
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes Xn
Risk Phrases 21/22-36/37/38
Safety Phrases S26;S36
RIDADR UN 1992 3/PG 3
WGK Germany 3
RTECS NY1412000
Packaging Group III
Hazard Class 3.2
HS Code 2915900090

 Precursor & DownStream

Precursor  2

DownStream  0

 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%

 Articles3

More Articles
Allyl isovalerate.

IARC Monogr. Eval. Carcinog. Risk Chem. Hum. 36 , 69-74, (1985)

Allyl isovalerate.

IARC Monogr. Eval. Carcinog. Risks Hum. 71 Pt 3 , 1241-4, (1999)

The effects of allyl isovalerate on the hematopoietic and immunologic systems in rodents.

Fundam. Appl. Toxicol. 10(4) , 655-63, (1988)

Female B6C3F1 mice plus male and female Fischer 344/N rats were gavaged with allyl isovalerate (AIV) in corn oil at 0, 31, 62, or 125 (mice) and 0, 31, 62, 125, or 250 (rats) mg/kg body weight for fiv...

 Synonyms

Allyl isovalerianate
Allyl isopentanoate
EINECS 220-609-7
allyl 3-methyl-2-butanoate
Allyl isovalerate
Allyl 3-methylbutanoate
Allyl 3-methylbutyrate
Isovaleriansaeure-allylester
MFCD00048350
3-methyl-butanoic acid,2-propenyl ester
Isovaleric acid,allyl ester
2-Propenyl isovalerate
Butanoic acid,3-methyl-,2-propenyl ester
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