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4-Methylcyclohexanecarboxylic acid

Product Name
4-Methylcyclohexanecarboxylic acid
CAS No.
4331-54-8
Chemical Name
4-Methylcyclohexanecarboxylic acid
Synonyms
4-METHYL-CYCLOHEXANECARBOXYLIC ACID;Cyclohexanecarboxylic acid,4-methyl-;4-METHYL-1-CYCLOHEXANECARBOXYLIC ACID;4-Methylcyclohexanecarboxylic Acid 4-Methyl-1-cyclohexanecarboxylic acid 99%;4-Methyl-1-cyclohexanecarboxylic acid 95+%;trans-4-Methyl-1-cyclohexanecarboxylic acid;4-METHYL-1-CYCLOHEXANECARBOXYLICACID(CIS+TRANS);4-MethylcyclohexanecarboxylicAcid(cis-andtrans-mixture)>4-Methylcyclohexanecarboxylic acid,mixture of cis and trans
CBNumber
CB3288195
Molecular Formula
C8H14O2
Formula Weight
142.2
MOL File
4331-54-8.mol
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4-Methylcyclohexanecarboxylic acid Property

Melting point:
110 °C
Boiling point:
134-136 °C/15 mmHg (lit.)
Density 
1.005 g/mL at 25 °C (lit.)
refractive index 
n20/D 1.4598(lit.)
Flash point:
>230 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform, DMSO, Methanol
pka
4.92±0.10(Predicted)
form 
Oil
color 
Clear Colorless
InChI
InChI=1S/C8H14O2/c1-6-2-4-7(5-3-6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
InChIKey
QTDXSEZXAPHVBI-UHFFFAOYSA-N
SMILES
C1(C(O)=O)CCC(C)CC1
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Safety

Hazard Codes 
Xn
Risk Statements 
22-36
Safety Statements 
26
WGK Germany 
2
HS Code 
29162090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H319Causes serious eye irritation

Precautionary statements

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
330620
Product name
4-Methyl-1-cyclohexanecarboxylic acid
Purity
99%
Packaging
5g
Price
$76.7
Updated
2023/01/07
TCI Chemical
Product number
M1621
Product name
4-Methylcyclohexanecarboxylic Acid (cis- and trans- mixture)
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$109
Updated
2025/07/31
TCI Chemical
Product number
M1621
Product name
4-Methylcyclohexanecarboxylic Acid (cis- and trans- mixture)
Purity
>98.0%(GC)(T)
Packaging
25g
Price
$326
Updated
2025/07/31
TRC
Product number
M299530
Product name
4-MethylcyclohexanecarboxylicAcid
Packaging
10g
Price
$110
Updated
2021/12/16
Matrix Scientific
Product number
113906
Product name
4-Methyl-1-cyclohexanecarboxylic acid
Purity
97%
Packaging
1g
Price
$134
Updated
2021/12/16
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4-Methylcyclohexanecarboxylic acid Chemical Properties,Usage,Production

Chemical Properties

Relative density 1.005, melting point 108-111°C, boiling point 134-136°C (15mmHg), refractive index 1.4598.

Uses

4-Methyl-1-cyclohexanecarboxylic acid was used to investigate the palladium core-porous silica shell-nanoparticles catalyzed hydrogenation of 4-carboxybenzaldehyde (4-CBA) to p-toluic acid. It was also used in the synthesis of substituted cyclohexyl carbonyl chlorides.

Synthesis

99-94-5

934-67-8

934-67-8

GENERAL STEPS: The hydrogenation reaction was carried out in a 25 mL stainless steel autoclave with a PTFE liner. In a typical experiment, 20 mg of catalyst and 61 mg (0.5 mmol) of p-toluic acid were dispersed in 5 mL of deionized water. After sealing the autoclave, the air in the autoclave was replaced with hydrogen and pressurized to 2.5 MPa. Subsequently, the reaction mixture was heated to 110 °C under magnetic stirring (1000 rpm). Upon completion of the reaction, it was cooled to room temperature, the reaction mixture was extracted with ethyl acetate and separated by centrifugation to remove the solid catalyst. The recovered solid catalyst was washed sequentially with ethyl acetate, ethanol and deionized water. The filtrate was analyzed by gas chromatography (GC, HP5890, USA) equipped with a 30 m HP-5 capillary column and a flame ionization detector (FID). All products were confirmed structurally by gas chromatography-mass spectrometry (GC-MS, Agilent 6890).

References

[1] Tetrahedron Letters, 2004, vol. 45, # 35, p. 6669 - 6672
[2] Steroids, 1983, vol. 41, # 3, p. 349 - 359
[3] Recueil des Travaux Chimiques des Pays-Bas, 1961, vol. 80, p. 595 - 607
[4] Recueil des Travaux Chimiques des Pays-Bas, 1961, vol. 80, p. 595 - 607
[5] Journal of the Chemical Society, 1937, p. 2003,2007

4-Methylcyclohexanecarboxylic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 4-Methylcyclohexanecarboxylic acid manufacturers

ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD
Product
4-Methylcyclohexanecarboxylic acid 4331-54-8
Price
US $3.00-9.00/KG
Min. Order
0.1KG
Purity
99%
Supply Ability
g-kg-tons, free sample is available
Release date
2025-06-24
Shanghai Yongzeng Technology Co.,Ltd
Product
4-methylcyclohexanecarboxylic acid 4331-54-8
Price
US $0.00/gm
Min. Order
100gm
Purity
99%min
Supply Ability
100kgs
Release date
2024-09-09
Wuhan Boyuan Import & Export Co., LTD
Product
4-Methylcyclohexanecarboxylic acid 4331-54-8
Price
US $9.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
50000tons
Release date
2023-05-31

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