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2-[(2-fluorophenyl)carbamoyl]acetic acid

2-[(2-fluorophenyl)carbamoyl]acetic acid

Formula: C9H8FNO3

SMILES: OC(=O)CC(=O)NC1=CC=CC=C1F

IUPAC: 2-[(2-fluorophenyl)carbamoyl]acetic acid

InChI: InChI=1S/C9H8FNO3/c10-6-3-1-2-4-7(6)11-8(12)5-9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)

Composition: C (54.83%), H (4.09%), F (9.64%), N (7.10%), O (24.34%)

Molar Mass: 197.165

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 197.048821285
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey XKNFEJCGPIJXKT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.48
Topological Polar Surface Area 66.4
Polarizability 17.38
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C9H8FNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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