N-(4-amino-2-chlorophenyl)propanamide

N-(4-amino-2-chlorophenyl)propanamide

CAS: 754193-08-3

Formula: C9H11ClN2O

SMILES: CCC(=O)NC1=C(Cl)C=C(N)C=C1

IUPAC: N-(4-amino-2-chlorophenyl)propanamide

InChI: InChI=1S/C9H11ClN2O/c1-2-9(13)12-8-4-3-6(11)5-7(8)10/h3-5H,2,11H2,1H3,(H,12,13)

Composition: C (54.42%), H (5.58%), Cl (17.85%), N (14.10%), O (8.05%)

Molar Mass: 198.65

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	198.0559907
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	GQPGEZWAHOTHOW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.05
Topological Polar Surface Area	55.12
Polarizability	20.09
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	754193-08-3		$58.65-$232.30$58.65$232.30