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(2S)-3-(4-fluorophenyl)-2-(phenylformamido)propanoic acid

(2S)-3-(4-fluorophenyl)-2-(phenylformamido)propanoic acid

CAS: 143120-37-0

Formula: C16H14FNO3

SMILES: OC(=O)[C@H](CC1=CC=C(F)C=C1)NC(=O)C1=CC=CC=C1

IUPAC: (2S)-3-(4-fluorophenyl)-2-(phenylformamido)propanoic acid

InChI: InChI=1S/C16H14FNO3/c17-13-8-6-11(7-9-13)10-14(16(20)21)18-15(19)12-4-2-1-3-5-12/h1-9,14H,10H2,(H,18,19)(H,20,21)/t14-/m0/s1

Composition: C (66.89%), H (4.91%), F (6.61%), N (4.88%), O (16.71%)

Molar Mass: 287.29

Atom Count: 35

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 287.095771478
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GORRHYQCWLMPBT-AWEZNQCLSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.45
Topological Polar Surface Area 66.4
Polarizability 28.49
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 143120-37-0 $340.20-$635.04$340.20$635.04
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