2-bromo-4-fluoro-5-nitrobenzaldehyde

2-bromo-4-fluoro-5-nitrobenzaldehyde

CAS: 1805556-76-6

Formula: C7H3BrFNO3

SMILES: [O-][N+](=O)C1=CC(C=O)=C(Br)C=C1F

IUPAC: 2-bromo-4-fluoro-5-nitrobenzaldehyde

InChI: InChI=1S/C7H3BrFNO3/c8-5-2-6(9)7(10(12)13)1-4(5)3-11/h1-3H

Composition: C (33.90%), H (1.22%), Br (32.22%), F (7.66%), N (5.65%), O (19.35%)

Molar Mass: 248.007

Atom Count: 16

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	246.928034
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FNYHMIHKYCGMGX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.8
Topological Polar Surface Area	60.21
Polarizability	17.09
Ring Count	1
Rotatable Bond Count	2

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