2-bromo-5-methoxy-4-nitroaniline

2-bromo-5-methoxy-4-nitroaniline

CAS: 1934530-44-5

Formula: C7H7BrN2O3

SMILES: COC1=CC(N)=C(Br)C=C1[N+]([O-])=O

IUPAC: 2-bromo-5-methoxy-4-nitroaniline

InChI: InChI=1S/C7H7BrN2O3/c1-13-7-3-5(9)4(8)2-6(7)10(11)12/h2-3H,9H2,1H3

Composition: C (34.03%), H (2.86%), Br (32.34%), N (11.34%), O (19.43%)

Molar Mass: 247.048

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	245.964005
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	QTAOAXDJMKPHEB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.16
Topological Polar Surface Area	78.39
Polarizability	18.94
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1934530-44-5		$56.75-$258.51$56.75$97.10$258.51