4,5-dichloro-2-nitroaniline

4,5-dichloro-2-nitroaniline

CAS: 6641-64-1

Formula: C6H4Cl2N2O2

SMILES: NC1=CC(Cl)=C(Cl)C=C1[N+]([O-])=O

IUPAC: 4,5-dichloro-2-nitroaniline

InChI: InChI=1S/C6H4Cl2N2O2/c7-3-1-5(9)6(10(11)12)2-4(3)8/h1-2H,9H2

Composition: C (34.81%), H (1.95%), Cl (34.25%), N (13.53%), O (15.46%)

Molar Mass: 207.01

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	205.9649828
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	FSGTULQLEVAYRS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.69
Topological Polar Surface Area	69.16
Polarizability	17.31
Ring Count	1
Rotatable Bond Count	1

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