1-methylcyclohexane-1-carboxylic acid

1-methylcyclohexane-1-carboxylic acid

CAS: 1123-25-7

Formula: C8H14O2

SMILES: CC1(CCCCC1)C(O)=O

IUPAC: 1-methylcyclohexane-1-carboxylic acid

InChI: InChI=1S/C8H14O2/c1-8(7(9)10)5-3-2-4-6-8/h2-6H2,1H3,(H,9,10)

Composition: C (67.57%), H (9.92%), O (22.50%)

Molar Mass: 142.198

Atom Count: 24

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	142.099379691
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	REHQLKUNRPCYEW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.35
Topological Polar Surface Area	37.3
Polarizability	15.26
Ring Count	1
Rotatable Bond Count	1

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