2-bromo-3,4,5-trifluoro-1-nitrobenzene

2-bromo-3,4,5-trifluoro-1-nitrobenzene

CAS: 1020718-01-7

Formula: C6HBrF3NO2

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

IUPAC: 2-bromo-3,4,5-trifluoro-1-nitrobenzene

InChI: InChI=1S/C6HBrF3NO2/c7-4-3(11(12)13)1-2(8)5(9)6(4)10/h1H

Composition: C (28.15%), H (0.39%), Br (31.22%), F (22.27%), N (5.47%), O (12.50%)

Molar Mass: 255.978

Atom Count: 14

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	254.914276
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RISQAVRTASTTPY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.65
Topological Polar Surface Area	43.14
Polarizability	15.08
Ring Count	1
Rotatable Bond Count	1

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