1-bromo-4-methoxy-2-nitrobenzene

1-bromo-4-methoxy-2-nitrobenzene

CAS: 5344-78-5

Formula: C7H6BrNO3

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

IUPAC: 1-bromo-4-methoxy-2-nitrobenzene

InChI: InChI=1S/C7H6BrNO3/c1-12-5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3

Composition: C (36.23%), H (2.61%), Br (34.44%), N (6.04%), O (20.69%)

Molar Mass: 232.033

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	230.953106
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KCOBIBRGPCFIGF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.46
Topological Polar Surface Area	52.37
Polarizability	17.76
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	5344-78-5		Quote Only

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	5344-78-5		$460.00-$700.00$460.00$700.00