1-(5-bromo-2-nitrophenyl)methanamine hydrochloride

1-(5-bromo-2-nitrophenyl)methanamine hydrochloride

CAS: 2703756-67-4

Formula: C7H8BrClN2O2

SMILES: Cl.NCC1=CC(Br)=CC=C1[N+]([O-])=O

IUPAC: 1-(5-bromo-2-nitrophenyl)methanamine hydrochloride

InChI: InChI=1S/C7H7BrN2O2.ClH/c8-6-1-2-7(10(11)12)5(3-6)4-9;/h1-3H,4,9H2;1H

Composition: C (31.43%), H (3.01%), Br (29.87%), Cl (13.25%), N (10.47%), O (11.96%)

Molar Mass: 267.51

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	265.945768
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YGJHJSCGKJTLTR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.47
Topological Polar Surface Area	69.16
Polarizability	18.5
Ring Count	1
Rotatable Bond Count	2

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