1-(3,5-dimethylphenyl)cyclopentane-1-carboxylic acid

1-(3,5-dimethylphenyl)cyclopentane-1-carboxylic acid

CAS: 919017-14-4

Formula: C14H18O2

SMILES: CC1=CC(=CC(C)=C1)C1(CCCC1)C(O)=O

IUPAC: 1-(3,5-dimethylphenyl)cyclopentane-1-carboxylic acid

InChI: InChI=1S/C14H18O2/c1-10-7-11(2)9-12(8-10)14(13(15)16)5-3-4-6-14/h7-9H,3-6H2,1-2H3,(H,15,16)

Composition: C (77.03%), H (8.31%), O (14.66%)

Molar Mass: 218.296

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	218.13067982
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NFYFKAXGSUWRBJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.92
Topological Polar Surface Area	37.3
Polarizability	24.68
Ring Count	2
Rotatable Bond Count	2

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