1-methylcyclohex-3-ene-1-carboxylic acid

1-methylcyclohex-3-ene-1-carboxylic acid

CAS: 16646-42-7

Formula: C8H12O2

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

IUPAC: 1-methylcyclohex-3-ene-1-carboxylic acid

InChI: InChI=1/C8H12O2/c1-8(7(9)10)5-3-2-4-6-8/h2-3H,4-6H2,1H3,(H,9,10)

Composition: C (68.55%), H (8.63%), O (22.83%)

Molar Mass: 140.182

Atom Count: 22

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	140.083729626
Formal Charge	0
FSP3	0.62
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FKOPGCJIAFSDAO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.46
Topological Polar Surface Area	37.3
Polarizability	15.01
Ring Count	1
Rotatable Bond Count	1

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