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2-fluoro-5-methyl-4'-nitro-1,1'-biphenyl

2-fluoro-5-methyl-4'-nitro-1,1'-biphenyl

CAS: 1373232-66-6

Formula: C13H10FNO2

SMILES: CC1=CC=C(F)C(=C1)C1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 2-fluoro-5-methyl-4'-nitro-1,1'-biphenyl

InChI: InChI=1S/C13H10FNO2/c1-9-2-7-13(14)12(8-9)10-3-5-11(6-4-10)15(16)17/h2-8H,1H3

Composition: C (67.53%), H (4.36%), F (8.22%), N (6.06%), O (13.84%)

Molar Mass: 231.226

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 231.069556729
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey DFLMFVBMAZNQQI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.77
Topological Polar Surface Area 43.14
Polarizability 24.55
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 1373232-66-6 $409.40-$1,386.90$409.40$1,386.90
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