2-amino-4,5-dichlorobenzonitrile

2-amino-4,5-dichlorobenzonitrile

CAS: 28568-04-9

Formula: C7H4Cl2N2

SMILES: NC1=C(C=C(Cl)C(Cl)=C1)C#N

IUPAC: 2-amino-4,5-dichlorobenzonitrile

InChI: InChI=1S/C7H4Cl2N2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-2H,11H2

Composition: C (44.96%), H (2.16%), Cl (37.91%), N (14.98%)

Molar Mass: 187.02

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	185.9751535
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	OERKZOSLSXFLMY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.09
Topological Polar Surface Area	49.81
Polarizability	17.12
Ring Count	1
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	28568-04-9		$184.00-$1,426.00$184.00$258.75$862.50$1,426.00