2-(2-chlorophenyl)butanoic acid

2-(2-chlorophenyl)butanoic acid

CAS: 188014-56-4

Formula: C10H11ClO2

SMILES: CCC(C(O)=O)C1=CC=CC=C1Cl

IUPAC: 2-(2-chlorophenyl)butanoic acid

InChI: InChI=1/C10H11ClO2/c1-2-7(10(12)13)8-5-3-4-6-9(8)11/h3-7H,2H2,1H3,(H,12,13)

Composition: C (60.46%), H (5.58%), Cl (17.85%), O (16.11%)

Molar Mass: 198.65

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	198.0447573
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HXXSYUKBUWEHOV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.35
Topological Polar Surface Area	37.3
Polarizability	20.09
Ring Count	1
Rotatable Bond Count	3

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