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1-(4-methoxyphenyl)cyclohexane-1-carboxylic acid

1-(4-methoxyphenyl)cyclohexane-1-carboxylic acid

CAS: 7469-83-2

Formula: C14H18O3

SMILES: COC1=CC=C(C=C1)C1(CCCCC1)C(O)=O

IUPAC: 1-(4-methoxyphenyl)cyclohexane-1-carboxylic acid

InChI: InChI=1S/C14H18O3/c1-17-12-7-5-11(6-8-12)14(13(15)16)9-3-2-4-10-14/h5-8H,2-4,9-10H2,1H3,(H,15,16)

Composition: C (71.77%), H (7.74%), O (20.49%)

Molar Mass: 234.295

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 234.12559444
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey JKJAJSWMKTWWJS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.91
Topological Polar Surface Area 46.53
Polarizability 25.51
Ring Count 2
Rotatable Bond Count 3

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