5-(4-methoxyphenyl)pentanoic acid

5-(4-methoxyphenyl)pentanoic acid

CAS: 7508-04-5

Formula: C12H16O3

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

IUPAC: 5-(4-methoxyphenyl)pentanoic acid

InChI: InChI=1S/C12H16O3/c1-15-11-8-6-10(7-9-11)4-2-3-5-12(13)14/h6-9H,2-5H2,1H3,(H,13,14)

Composition: C (69.21%), H (7.74%), O (23.05%)

Molar Mass: 208.257

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	208.109944375
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BGPOHJSGSYVQSU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.63
Topological Polar Surface Area	46.53
Polarizability	22.49
Ring Count	1
Rotatable Bond Count	6

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