CAS 765-87-7|1,2-Cyclohexanedione

Introduction:Basic information about CAS 765-87-7|1,2-Cyclohexanedione, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name1,2-Cyclohexanedione
CAS Number765-87-7Molecular Weight112.127
Density1.1±0.1 g/cm3Boiling Point194.0±9.0 °C at 760 mmHg
Molecular FormulaC6H8O2Melting Point35 °C
MSDSChineseUSAFlash Point66.9±4.4 °C

Names

Namecyclohexane-1,2-dione
SynonymMore Synonyms

1,2-Cyclohexanedione BiologicalActivity

Description1,2-Cyclohexanedione is an endogenous metabolite.
Related CatalogResearch Areas >>Metabolic Disease

Chemical & Physical Properties

Density1.1±0.1 g/cm3
Boiling Point194.0±9.0 °C at 760 mmHg
Melting Point35 °C
Molecular FormulaC6H8O2
Molecular Weight112.127
Flash Point66.9±4.4 °C
Exact Mass112.052429
PSA34.14000
LogP0.11
Vapour Pressure0.5±0.4 mmHg at 25°C
Index of Refraction1.474
InChIKeyOILAIQUEIWYQPH-UHFFFAOYSA-N
SMILESO=C1CCCCC1=O
Storage condition0-6°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GV0340000
CHEMICAL NAME :
1,2-Cyclohexanedione
CAS REGISTRY NUMBER :
765-87-7
BEILSTEIN REFERENCE NO. :
0507419
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C6-H8-O2
MOLECULAR WEIGHT :
112.14
WISWESSER LINE NOTATION :
L6VVTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 mg/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 67,367,1979

Safety Information

Personal Protective EquipmentEyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard CodesXn:Harmful
Risk PhrasesR22
Safety PhrasesS24/25
RIDADR1325.0
WGK Germany3
RTECSGV0340000
Hazard Class4.1
HS Code2914299000

Customs

HS Code2914299000
Summary2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Articles27

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Modification of arginine-198 in sarcoplasmic reticulum Ca2+-ATPase by 1,2-cyclohexanedione causes inhibition of formation of the phosphoenzyme intermediate from inorganic phosphate.

J. Biol. Chem. 272(34) , 21142-50, (1997)

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Synonyms

Cyclohexan-1,2-dion
L6VVTJ
1,2-Cyclohexadione
EINECS 212-155-3
Cyclohexan-1,2-dione
1,2-Cyclohexanedione
MFCD04971978
Cyclohexane-1,2-dione
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