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Safety Information

330612

Sigma-Aldrich

3-Methyl-1-cyclohexanecarboxylic acid, mixture of cis and trans

98%

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About This Item

Linear Formula:
CH3C6H10CO2H
CAS Number:
13293-59-9
Molecular Weight:
142.20
EC Number:
236-314-1
MDL number:
MFCD00074908
UNSPSC Code:
12352100
PubChem Substance ID:
24859395
NACRES:
NA.22

Assay

98%

form

liquid

refractive index

n20/D 1.459 (lit.)

density

0.989 g/mL at 25 °C (lit.)

SMILES string

CC1CCCC(C1)C(O)=O

InChI

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

InChI key

CIFSKZDQGRCLBN-UHFFFAOYSA-N

Application

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.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

330612-50G:
330612-VAR:
330612-BULK:
330612-10G:

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Certificates of Analysis (COA)

Lot/Batch Number
0000188445
07096KMV
07096KM
50296EK
00912LG

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