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2-(2-fluorobenzamido)-5-methylbenzoic acid

2-(2-fluorobenzamido)-5-methylbenzoic acid

CAS: 672300-51-5

Formula: C15H12FNO3

SMILES: CC1=CC(C(O)=O)=C(NC(=O)C2=C(F)C=CC=C2)C=C1

IUPAC: 2-(2-fluorobenzamido)-5-methylbenzoic acid

InChI: InChI=1S/C15H12FNO3/c1-9-6-7-13(11(8-9)15(19)20)17-14(18)10-4-2-3-5-12(10)16/h2-8H,1H3,(H,17,18)(H,19,20)

Composition: C (65.93%), H (4.43%), F (6.95%), N (5.13%), O (17.56%)

Molar Mass: 273.263

Atom Count: 32

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 273.080121413
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GOSMLPRRRTZSAB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.11
Topological Polar Surface Area 66.4
Polarizability 26.73
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 672300-51-5 $51.35-$86.31$51.35$63.37$86.31
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