2-chloro-1-phenylpropan-1-one

2-chloro-1-phenylpropan-1-one

CAS: 6084-17-9

Formula: C9H9ClO

SMILES: CC(Cl)C(=O)C1=CC=CC=C1

IUPAC: 2-chloro-1-phenylpropan-1-one

InChI: InChI=1/C9H9ClO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7H,1H3

Composition: C (64.11%), H (5.38%), Cl (21.02%), O (9.49%)

Molar Mass: 168.62

Atom Count: 20

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	168.0341926
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	AXCPQHPNAZONTH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.71
Topological Polar Surface Area	17.07
Polarizability	17.72
Ring Count	1
Rotatable Bond Count	2

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