1-bromo-4,5-difluoro-2-nitrobenzene

1-bromo-4,5-difluoro-2-nitrobenzene

CAS: 321-17-5

Formula: C6H2BrF2NO2

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

IUPAC: 1-bromo-4,5-difluoro-2-nitrobenzene

InChI: InChI=1S/C6H2BrF2NO2/c7-3-1-4(8)5(9)2-6(3)10(11)12/h1-2H

Composition: C (30.28%), H (0.85%), Br (33.57%), F (15.97%), N (5.89%), O (13.45%)

Molar Mass: 237.988

Atom Count: 14

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	236.923698
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	UWPUJVOSEQMMQE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.43
Topological Polar Surface Area	43.14
Polarizability	15.07
Ring Count	1
Rotatable Bond Count	1

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