6-(4-bromobenzoyl)-7-nitro-2,3-dihydro-1,4-benzodioxine

6-(4-bromobenzoyl)-7-nitro-2,3-dihydro-1,4-benzodioxine

Formula: C15H10BrNO5

SMILES: [O-][N+](=O)C1=CC2=C(OCCO2)C=C1C(=O)C1=CC=C(Br)C=C1

IUPAC: 6-(4-bromobenzoyl)-7-nitro-2,3-dihydro-1,4-benzodioxine

InChI: InChI=1S/C15H10BrNO5/c16-10-3-1-9(2-4-10)15(18)11-7-13-14(22-6-5-21-13)8-12(11)17(19)20/h1-4,7-8H,5-6H2

Composition: C (49.48%), H (2.77%), Br (21.94%), N (3.85%), O (21.97%)

Molar Mass: 364.151

Atom Count: 32

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	362.974235
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	KGKBNNYHPQMGRV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.53
Topological Polar Surface Area	78.67
Polarizability	31.09
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H10BrNO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00