3,5,5-Trimethylhexanal

Modify Date: 2024-01-02 11:32:19

3,5,5-Trimethylhexanal Structure
3,5,5-Trimethylhexanal structure
Common Name 3,5,5-Trimethylhexanal
CAS Number 5435-64-3 Molecular Weight 142.23900
Density 0.817 g/mL at 25 °C(lit.) Boiling Point 67-68 °C2.5 mm Hg(lit.)
Molecular Formula C9H18O Melting Point N/A
MSDS Chinese USA Flash Point 116 °F
Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Warning

 Names

Name 3,5,5-Trimethylhexanal
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.817 g/mL at 25 °C(lit.)
Boiling Point 67-68 °C2.5 mm Hg(lit.)
Molecular Formula C9H18O
Molecular Weight 142.23900
Flash Point 116 °F
Exact Mass 142.13600
PSA 17.07000
LogP 2.64770
Index of Refraction n20/D 1.421(lit.)

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MN7820000
CHEMICAL NAME :
Hexanal, 3,5,5-trimethyl-
CAS REGISTRY NUMBER :
5435-64-3
BEILSTEIN REFERENCE NO. :
1740882
LAST UPDATED :
199712
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C9-H18-O
MOLECULAR WEIGHT :
142.27

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,841,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3240 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,841,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,841,1982 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7970 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 1557 (estimated) No. of Female Employees: 276 (estimated)

 Safety Information

Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Warning
Hazard Statements H226-H315-H317-H412
Precautionary Statements P273-P280
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes Xi
Risk Phrases 10-36/37/38
Safety Phrases S16-S26-S36/37/39
RIDADR UN 1989 3/PG 3
WGK Germany 1
RTECS MN7820000
Packaging Group III
Hazard Class 3.2
HS Code 2912190090

 Synthetic Route

 Customs

HS Code 2912190090
Summary 2912190090 acyclic aldehydes without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Articles1

More Articles
gem-Dithiols1. Cairns TL, et al.

J. Am. Chem. Soc. 74(16) , 3982-89, (1952)

 Synonyms

3,5,5-trimethylhexanal
EINECS 226-603-0
MFCD00010441
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