2-bromo-4-chloro-6-nitroaniline

2-bromo-4-chloro-6-nitroaniline

CAS: 827-25-8

Formula: C6H4BrClN2O2

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

IUPAC: 2-bromo-4-chloro-6-nitroaniline

InChI: InChI=1S/C6H4BrClN2O2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H,9H2

Composition: C (28.66%), H (1.60%), Br (31.78%), Cl (14.10%), N (11.14%), O (12.72%)

Molar Mass: 251.46

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	249.914468
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NPCIWMOFULRTDX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.51
Topological Polar Surface Area	69.16
Polarizability	18.37
Ring Count	1
Rotatable Bond Count	1

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