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1,2,3,4-tetrafluoro-5-nitrobenzene

1,2,3,4-tetrafluoro-5-nitrobenzene

CAS: 5580-79-0

Formula: C6HF4NO2

SMILES: FC1=CC(=C(F)C(F)=C1F)N(=O)=O

IUPAC: 1,2,3,4-tetrafluoro-5-nitrobenzene

InChI: InChI=1S/C6HF4NO2/c7-2-1-3(11(12)13)5(9)6(10)4(2)8/h1H

Composition: C (36.94%), H (0.52%), F (38.96%), N (7.18%), O (16.40%)

Molar Mass: 195.073

Atom Count: 14

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 194.994340928
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey MKMDVNZEIQDZEP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.25
Topological Polar Surface Area 45.82
Polarizability 11.81
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 5580-79-0 $34.05-$97.10$34.05$47.92$97.10
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