2-Octanone, 3-methyl-

Modify Date: 2025-08-25 18:28:43

2-Octanone, 3-methyl- Structure
2-Octanone, 3-methyl- structure
 Common Name 2-Octanone, 3-methyl-
CAS Number 6137-08-2 Molecular Weight 142.23900
Density 0.814g/cm3 Boiling Point 180ºC at 760 mmHg
Molecular Formula C9H18O Melting Point N/A
MSDS N/A Flash Point 57.6ºC

 Names

Name 2-Octanone, 3-methyl
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.814g/cm3
Boiling Point 180ºC at 760 mmHg
Molecular Formula C9H18O
Molecular Weight 142.23900
Flash Point 57.6ºC
Exact Mass 142.13600
PSA 17.07000
LogP 2.79180
Index of Refraction 1.415
InChIKey XSWHAOGCTCBDIT-UHFFFAOYSA-N
SMILES CCCCCC(C)C(C)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RH1530000
CHEMICAL NAME :
2-Octanone, 3-methyl-
CAS REGISTRY NUMBER :
6137-08-2
BEILSTEIN REFERENCE NO. :
1746274
LAST UPDATED :
199801
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H18-O
MOLECULAR WEIGHT :
142.27
WISWESSER LINE NOTATION :
5Y1&V1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01340

 Safety Information

HS Code 2914190090

 Customs

HS Code 2914190090
Summary 2914190090 other acyclic ketones without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Synonyms

6-methyl-7-oxooctane acid
3-methyloctan-2-one
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