ChemicalBook--->CAS DataBase List--->13293-59-9

13293-59-9

13293-59-9 Structure

13293-59-9 Structure
IdentificationBack Directory
[Name]

3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID
[CAS]

13293-59-9
[Synonyms]

3-methylcyclohexanecarboxylic acid
3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID
3-methylcyclohexane-1-carboxylic acid
Cyclohexanecarboxylic acid, 3-methyl-
3-Methyl-1-cyclohexanecarboxylic acid,mixture of cis and trans
3-Methyl-1-cyclohexanecarboxylic acid, mixture of cis and trans 98%
3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID, 9 8%, MIXTURE OF CIS AND TRANS
[EINECS(EC#)]

236-314-1
[Molecular Formula]

C8H14O2
[MDL Number]

MFCD00074908
[MOL File]

13293-59-9.mol
[Molecular Weight]

142.2
Chemical PropertiesBack Directory
[Melting point ]

175℃ (decomposition) (benzene ligroine )
[Boiling point ]

136-138℃ (17 Torr)
[density ]

0.989 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.459(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

liquid
[InChI]

InChI=1S/C8H14O2/c1-6-3-2-4-7(5-6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
[InChIKey]

CIFSKZDQGRCLBN-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)CCCC(C)C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H317-H319
[Precautionary statements ]

P280-P305+P351+P338
[WGK Germany ]

3
Hazard InformationBack Directory
[Uses]

3-Methyl-1-cyclohexanecarboxylic acid was employed as a model naphthenic acid for quantitative determination of naphthenic acids in water by liquid chromatography-accurate mass time-of-flight mass spectrometry. It was also used in the synthesis of substituted cyclohexyl carbonyl chlorides.
Spectrum DetailBack Directory
[Spectrum Detail]

3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID(13293-59-9)1HNMR
3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID(13293-59-9)Raman
3-METHYL-1-CYCLOHEXANECARBOXYLIC ACID(13293-59-9)IR
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