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(2E)-3-(4-chlorophenyl)prop-2-enamide

(2E)-3-(4-chlorophenyl)prop-2-enamide

CAS: 18166-64-8

Formula: C9H8ClNO

SMILES: NC(=O)C=CC1=CC=C(Cl)C=C1

IUPAC: (2E)-3-(4-chlorophenyl)prop-2-enamide

InChI: InChI=1S/C9H8ClNO/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6H,(H2,11,12)/b6-3+

Composition: C (59.52%), H (4.44%), Cl (19.52%), N (7.71%), O (8.81%)

Molar Mass: 181.62

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.0294416
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PWXPFYVNYKVJBW-ZZXKWVIFSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.69
Topological Polar Surface Area 43.09
Polarizability 18.68
Ring Count 1
Rotatable Bond Count 2

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