2-amino-N-(3-chlorophenyl)-2-cyanoacetamide

2-amino-N-(3-chlorophenyl)-2-cyanoacetamide

CAS: 64145-18-2

Formula: C9H8ClN3O

SMILES: NC(C#N)C(=O)NC1=CC(Cl)=CC=C1

IUPAC: 2-amino-N-(3-chlorophenyl)-2-cyanoacetamide

InChI: InChI=1/C9H8ClN3O/c10-6-2-1-3-7(4-6)13-9(14)8(12)5-11/h1-4,8H,12H2,(H,13,14)

Composition: C (51.57%), H (3.85%), Cl (16.91%), N (20.05%), O (7.63%)

Molar Mass: 209.63

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	209.0355896
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	HRKJLHRWKDNXGY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.04
Topological Polar Surface Area	78.91
Polarizability	20.33
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	64145-18-2		$2,200.00-$4,410.00$2,200.00$3,520.00$4,410.00