3-chloro-N-(3-hydroxyphenyl)propanamide

3-chloro-N-(3-hydroxyphenyl)propanamide

CAS: 50297-40-0

Formula: C9H10ClNO2

SMILES: OC1=CC=CC(NC(=O)CCCl)=C1

IUPAC: 3-chloro-N-(3-hydroxyphenyl)propanamide

InChI: InChI=1S/C9H10ClNO2/c10-5-4-9(13)11-7-2-1-3-8(12)6-7/h1-3,6,12H,4-5H2,(H,11,13)

Composition: C (54.15%), H (5.05%), Cl (17.76%), N (7.02%), O (16.03%)

Molar Mass: 199.63

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	199.0400063
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	PNLKLWHMPQKCEV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.35
Topological Polar Surface Area	49.33
Polarizability	19.51
Ring Count	1
Rotatable Bond Count	3

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