2,4-dibromo-5-nitrobenzoic acid

2,4-dibromo-5-nitrobenzoic acid

CAS: 2065250-44-2

Formula: C7H3Br2NO4

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

IUPAC: 2,4-dibromo-5-nitrobenzoic acid

InChI: InChI=1S/C7H3Br2NO4/c8-4-2-5(9)6(10(13)14)1-3(4)7(11)12/h1-2H,(H,11,12)

Composition: C (25.88%), H (0.93%), Br (49.19%), N (4.31%), O (19.70%)

Molar Mass: 324.912

Atom Count: 17

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	322.842884
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NSCXDORRNNSMPO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.88
Topological Polar Surface Area	80.44
Polarizability	20.94
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	2065250-44-2		$201.25-$948.75$201.25$287.50$575.00$948.75