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CAS No.: | 39668-86-5 |
---|---|
Name: | p-Menthane-3-carboxylic acid |
Article Data: | 12 |
Molecular Structure: | |
Formula: | C11H20O2 |
Molecular Weight: | 184.279 |
Synonyms: | Cyclohexanecarboxylic acid, 5-methyl-2-(1-methylethyl)-;2-Isopropyl-5-methylcyclohexanecarboxylic acid;5-methyl-2-propan-2-yl-cyclohexane-1-carboxylic acid; |
EINECS: | 254-582-8 |
Density: | 0.965 g/cm3 |
Boiling Point: | 270.9 °C at 760 mmHg |
Flash Point: | 131.8 °C |
PSA: | 37.30000 |
LogP: | 2.77940 |
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Molecule structure of p-Menthane-3-carboxylic acid (CAS NO.39668-86-5):
IUPAC Name: 5-Methyl-2-propan-2-ylcyclohexane-1-carboxylic acid
Molecular Weight: 184.2753 g/mol
Molecular Formula: C11H20O2
Density: 0.965 g/cm3
Boiling Point: 270.9 °C at 760 mmHg
Flash Point: 131.8 °C
Index of Refraction: 1.46
Molar Refractivity: 52.35 cm3
Molar Volume: 190.8 cm3
Surface Tension: 32.3 dyne/cm
Enthalpy of Vaporization: 56.03 kJ/mol
Vapour Pressure: 0.00187 mmHg at 25 °C
XLogP3-AA: 3.4
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 2
Exact Mass: 184.14633
MonoIsotopic Mass: 184.14633
Topological Polar Surface Area: 37.3
Heavy Atom Count: 13
Canonical SMILES: CC1CCC(C(C1)C(=O)O)C(C)C
InChI: InChI=1S/C11H20O2/c1-7(2)9-5-4-8(3)6-10(9)11(12)13/h7-10H,4-6H2,1-3H3,(H,12,13)
InChIKey: MNVSUVYRIVXDBK-UHFFFAOYSA-N
EINECS of p-Menthane-3-carboxylic acid (CAS NO.39668-86-5): 254-582-8
p-Menthane-3-carboxylic acid (CAS NO.39668-86-5) is also named as 2-Isopropyl-5-methylcyclohexanecarboxylic acid ; cyclohexanecarboxylic acid, 5-methyl-2-(1-methylethyl)- ; [1R-(1alpha,2beta,5alpha)]-2-(isopropyl)-5-methylcyclohexanecarboxylic acid ; AI3-32584 .