2-chloro-N-(3-chloro-4-fluorophenyl)propanamide

2-chloro-N-(3-chloro-4-fluorophenyl)propanamide

CAS: 868771-19-1

Formula: C9H8Cl2FNO

SMILES: CC(Cl)C(=O)NC1=CC(Cl)=C(F)C=C1

IUPAC: 2-chloro-N-(3-chloro-4-fluorophenyl)propanamide

InChI: InChI=1/C9H8Cl2FNO/c1-5(10)9(14)13-6-2-3-8(12)7(11)4-6/h2-5H,1H3,(H,13,14)

Composition: C (45.79%), H (3.42%), Cl (30.03%), F (8.05%), N (5.93%), O (6.78%)

Molar Mass: 236.07

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	234.9966974
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YVPGRZXOVIMESQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.19
Topological Polar Surface Area	29.1
Polarizability	20.6
Ring Count	1
Rotatable Bond Count	2

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