4-(4-fluoro-3-methylphenyl)butanoic acid

4-(4-fluoro-3-methylphenyl)butanoic acid

CAS: 331-43-1

Formula: C11H13FO2

SMILES: CC1=C(F)C=CC(CCCC(O)=O)=C1

IUPAC: 4-(4-fluoro-3-methylphenyl)butanoic acid

InChI: InChI=1S/C11H13FO2/c1-8-7-9(5-6-10(8)12)3-2-4-11(13)14/h5-7H,2-4H2,1H3,(H,13,14)

Composition: C (67.33%), H (6.68%), F (9.68%), O (16.31%)

Molar Mass: 196.221

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.089957822
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FULMKQGHCXYECN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.83
Topological Polar Surface Area	37.3
Polarizability	19.66
Ring Count	1
Rotatable Bond Count	4

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