L-Phenylglycine

C₈H₉NO₂CAS 2935-35-5151.16 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₈H₉NO₂
Molar mass: 151.16 g/mol
Exact mass: 151.0633 Da
Melting point: 225–228 °C
logP: 0.77Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Hazards

Warning

H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2935-35-5

SMILES

N[C@H](C(=O)O)c1ccccc1

InChIKey

ZGUNAGUHMKGQNY-ZETCQYMHSA-N

InChI

InChI=1S/C8H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H,10,11)/t7-/m0/s1

Weigh it out

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

Names and synonyms

23 names · show all

Benzeneacetic acid, α-amino-, (αS)-
Glycine, 2-phenyl-, L-
Benzeneacetic acid, α-amino-, (S)-
(αS)-α-Aminobenzeneacetic acid
L-2-Phenylglycine
L-(+)-2-Phenylglycine
L-α-Phenylglycine
L-(+)-α-Aminophenylacetic acid
(S)-Phenylglycine
(S)-α-Aminobenzeneacetic acid
L-(+)-Phenylglycine
(S)-(+)-Phenylglycine
(+)-Phenylglycine
L-α-Aminophenylacetic acid
(S)-(+)-2-Phenylglycine
S-(+)-α-Phenylglycine
(S)-Amino(phenyl)acetic acid
NSC 206293
(S)-2-Amino-2-(phenyl)ethanoic acid
L(+)-α-Phenylglycine
(S)-2-Amino-2-(phenyl)acetic acid
(2S)-2-Azaniumyl-2-phenylacetate
(2S)-2-Amino-2-phenylacetic acid

Work with L-Phenylglycine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(-)-Phenylglycine875-74-1Enantiomer Phenylglycine2835-06-5Stereo not defined DL-Phenylglycine69-91-0Stereo not defined

Similar compounds

D-P-Hydroxyphenylglycine22818-40-269 % similar Oxfenicine32462-30-969 % similar 4-Hydroxyphenylglycine938-97-669 % similar 2-Amino-2-(4-methylphenyl)acetic acid13227-01-565 % similar (S)-4-Fluorophenylglycine19883-57-965 % similar α-Amino-4-chlorobenzeneacetic acid6212-33-565 % similar (2S)-2-Amino-2-(4-chlorophenyl)acetic acid67336-19-065 % similar α-Amino-4-chlorobenzeneacetic acid7292-70-865 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Ethyl-4-nitrobenzene100-12-9 N-Phenylglycine103-01-5 Acetaminophen103-90-2 4-(Methylamino)benzoic acid10541-83-0 N-Methylanthranilic acid119-68-6 4-Aminophenylacetic acid1197-55-3 2,6-Dimethyl-4-nitrosophenol13331-93-6 Methyl anthranilate134-20-3

Elsewhere

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