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2-[(4-fluorophenyl)carbamoyl]benzoic acid

2-[(4-fluorophenyl)carbamoyl]benzoic acid

CAS: 19336-77-7

Formula: C14H10FNO3

SMILES: OC(=O)C1=C(C=CC=C1)C(=O)NC1=CC=C(F)C=C1

IUPAC: 2-[(4-fluorophenyl)carbamoyl]benzoic acid

InChI: InChI=1S/C14H10FNO3/c15-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)14(18)19/h1-8H,(H,16,17)(H,18,19)

Composition: C (64.87%), H (3.89%), F (7.33%), N (5.40%), O (18.51%)

Molar Mass: 259.236

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 259.064471349
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey FZGQSGHYCVVQEA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.06
Topological Polar Surface Area 66.4
Polarizability 24.98
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 19336-77-7 $125.13-$192.51$125.13$192.51
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