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1,2-difluoro-3-nitrobenzene

1,2-difluoro-3-nitrobenzene

CAS: 6921-22-8

Formula: C6H3F2NO2

SMILES: FC1=C(F)C(=CC=C1)N(=O)=O

IUPAC: 1,2-difluoro-3-nitrobenzene

InChI: InChI=1S/C6H3F2NO2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H

Composition: C (45.30%), H (1.90%), F (23.88%), N (8.80%), O (20.11%)

Molar Mass: 159.092

Atom Count: 14

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 159.013184667
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IXIJRPBFPLESEI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.82
Topological Polar Surface Area 45.82
Polarizability 11.86
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 6921-22-8 $27.74-$1,150.03$27.74$84.49$141.23$313.99$1,150.03
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