N-Formyl-L-phenylalanine

C₁₀H₁₁NO₃CAS 13200-85-6193.20 g/mol

Open in Covalent MOL file

Carboxylic acid

Properties

Molecular formula: C₁₀H₁₁NO₃
Molar mass: 193.20 g/mol
Exact mass: 193.0739 Da
Melting point: 161–162 °C
logP: 1.27Crippen estimate
Polar surface area: 69.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 4
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

13200-85-6

SMILES

O=C(O)[C@H](Cc1ccccc1)N=CO

InChIKey

NSTPXGARCQOSAU-VIFPVBQESA-N

InChI

InChI=1S/C10H11NO3/c12-7-11-9(10(13)14)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,11,12)(H,13,14)/t9-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

L-Phenylalanine, N-formyl-
Alanine, N-formyl-3-phenyl-, L-
L-Alanine, N-formyl-3-phenyl-
L-N-Formylphenylalanine
N-Formylphenylalanine
N-Formyl-3-phenylalanine
NSC 334342
(2S)-2-Formamido-3-phenylpropanoic acid

Work with N-Formyl-L-phenylalanine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Benzoyl-L-phenylalanine2566-22-562 % similar N-Benzoyl-dl-phenylalanine2901-76-062 % similar (-)-N-Acetylphenylalanine10172-89-159 % similar N-Acetyl-L-phenylalanine2018-61-359 % similar N-Acetyl-dl-phenylalanine2901-75-959 % similar Glycylphenylalanine3321-03-757 % similar Glycylphenylalanine721-66-457 % similar N-(2-Chloroacetyl)phenylalanine7765-11-956 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Benzoyl-dl-alanine1205-02-3 Methyl 4-((hydroxyimino)methyl)-2-methylbenzoate1261169-50-9 (3S)-7-Hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid128502-56-7 Ethyl oxanilate1457-85-8 N-Acetyl-dl-phenylglycine15962-46-6 Actarit18699-02-0 3,4,5-Trimethoxybenzonitrile1885-35-4 N-Benzoyl-L-alanine2198-64-3

Elsewhere

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