CAS No.13064-83-0,trans-4-Methylcyclohexanecarboxylic acid Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	13064-83-0
Name:	trans-4-Methylcyclohexanecarboxylic acid
Article Data:	28

Formula:	C₈H₁₄O₂
Molecular Weight:	142.198
Synonyms:	trans-4-Methylcyclohexane-1-carboxylicacid;
EINECS:	235-959-6
Density:	1.025 g/cm³
Melting Point:	109-111 °C(lit.)
Boiling Point:	247.467 °C at 760 mmHg
Flash Point:	110.727 °C
Risk Codes:	36/37/38
Safety:	24/25
PSA:	37.30000
LogP:	1.89730

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Specification

The CAS register number of trans-4-Methylcyclohexanecarboxylic acid is 13064-83-0. It also can be called as Cyclohexanecarboxylicacid, 4-methyl-, trans- and the systematic name about this chemical is trans-4-methylcyclohexanecarboxylic acid. The molecular formula about this chemical is C₈H₁₄O₂and the molecular weight is 142.20. It belongs to the following product categories which include Biphenyl & Diphenyl ether; (intermediate of glimepiride); 4-Alkylcyclohexanecarboxylic Acids (Building Blocks for Liquid Crystals); 4-Substituted Cyclohexanecarboxylic Acids; Building Blocks for Liquid Crystals; Functional Materials; C8; Carbonyl Compounds; Carboxylic Acids and so on.

Physical properties about trans-4-Methylcyclohexanecarboxylic acid are: (1)ACD/LogP: 2.19; (2)ACD/LogD (pH 5.5): 2; (3)ACD/BCF (pH 5.5): 8; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 103; (6)ACD/KOC (pH 7.4): 2; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 37.3Å²; (11)Index of Refraction: 1.467; (12)Molar Refractivity: 38.486 cm³; (13)Molar Volume: 138.695 cm³; (14)Polarizability: 15.257x10^-24cm³; (15)Surface Tension: 35.663 dyne/cm; (16)Enthalpy of Vaporization: 53.367 kJ/mol; (17)Boiling Point: 247.467 °C at 760 mmHg; (18)Vapour Pressure: 0.008 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H]1CC[C@@H](C)CC1
(2)InChI: InChI=1/C8H14O2/c1-6-2-4-7(5-3-6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7-
(3)InChIKey: QTDXSEZXAPHVBI-LJGSYFOKBM
(4)Std. InChI: InChI=1S/C8H14O2/c1-6-2-4-7(5-3-6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7-
(5)Std. InChIKey: QTDXSEZXAPHVBI-LJGSYFOKSA-N