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2-bromo-1,5-difluoro-3-nitrobenzene

2-bromo-1,5-difluoro-3-nitrobenzene

CAS: 877161-74-5

Formula: C6H2BrF2NO2

SMILES: [O-][N+](=O)C1=CC(F)=CC(F)=C1Br

IUPAC: 2-bromo-1,5-difluoro-3-nitrobenzene

InChI: InChI=1S/C6H2BrF2NO2/c7-6-4(9)1-3(8)2-5(6)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 FCYPTYIIKJMNJZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.43
Topological Polar Surface Area 43.14
Polarizability 15.08
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 877161-74-5 $18.92-$556.10$18.92$45.40$163.93$556.10
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