.beta.-Neopentylallyl alcohol

Modify Date: 2024-01-12 19:17:08

.beta.-Neopentylallyl alcohol Structure
.beta.-Neopentylallyl alcohol structure
Common Name .beta.-Neopentylallyl alcohol
CAS Number 4379-17-3 Molecular Weight 128.21200
Density 0.837g/cm3 Boiling Point 159ºC at 760 mmHg
Molecular Formula C8H16O Melting Point N/A
MSDS N/A Flash Point 56.3ºC

 Names

Name 4,4-dimethyl-2-methylidenepentan-1-ol
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.837g/cm3
Boiling Point 159ºC at 760 mmHg
Molecular Formula C8H16O
Molecular Weight 128.21200
Flash Point 56.3ºC
Exact Mass 128.12000
PSA 20.23000
LogP 1.97110
Index of Refraction 1.438

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UD5425000
CHEMICAL NAME :
2-Propen-1-ol, beta-neopentyl-
CAS REGISTRY NUMBER :
4379-17-3
BEILSTEIN REFERENCE NO. :
1700644
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C8-H16-O
MOLECULAR WEIGHT :
128.24
WISWESSER LINE NOTATION :
Q1YU1&1X1&1&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 :
SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,7,1961 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,7,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,7,1961

 Safety Information

HS Code 2905290000

 Synthetic Route

~%

.beta.-Neopentylallyl alcohol Structure

.beta.-Neopenty...

CAS#:4379-17-3

Literature: Byers; Hickinbottom Journal of the Chemical Society, 1948 , p. 1328,1329

~%

.beta.-Neopentylallyl alcohol Structure

.beta.-Neopenty...

CAS#:4379-17-3

Literature: Gasson et al. Journal of the Chemical Society, 1954 , p. 2170,2177

~%

.beta.-Neopentylallyl alcohol Structure

.beta.-Neopenty...

CAS#:4379-17-3

Literature: Bilas, W.; Hoebold, W.; Pritzkow, W. Journal fuer Praktische Chemie (Leipzig), 1982 , vol. 324, # 1 p. 125 - 141

~0%

.beta.-Neopentylallyl alcohol Structure

.beta.-Neopenty...

CAS#:4379-17-3

Detail
Literature: Bilas, W.; Hoebold, W.; Pritzkow, W. Journal fuer Praktische Chemie (Leipzig), 1982 , vol. 324, # 1 p. 125 - 141

 Customs

HS Code 2905290000
Summary 2905290000 unsaturated monohydric alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Synonyms

2-Neopentyl-2-propen-1-ol
2-Methylol-4,4-dimethylpent-1-en
2-neopentyl-allyl alcohol
2-Neopentyl-allylalkohol