Alpha-Amino-2-naphthalenepropanoic acid

C₁₃H₁₃NO₂CAS 14108-60-2215.25 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₁₃H₁₃NO₂
Molar mass: 215.25 g/mol
Exact mass: 215.0946 Da
logP: 1.79Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Identifiers

CAS number

14108-60-2

SMILES

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)O)N

InChIKey

JPZXHKDZASGCLU-UHFFFAOYSA-N

InChI

InChI=1S/C13H13NO2/c14-12(13(15)16)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8,14H2,(H,15,16)

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

Names and synonyms

1 names

H-Dl-2-nal-oh

Work with Alpha-Amino-2-naphthalenepropanoic acid

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

(2S)-2-Amino-3-(naphthalen-2-yl)propanoic acid hydrochloride122745-12-492 % similar Phenylalanine63-91-267 % similar D-Phenylalanine673-06-367 % similar D-Dopa5796-17-863 % similar L-M-Tyrosine587-33-763 % similar Dopa59-92-763 % similar Dl-dopa63-84-363 % similar Dl-M-tyrosine775-06-463 % similar

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

Same formula

4-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid15898-26-7 2-Naphthylalanine58438-03-2 D-3-(2-Naphthyl)alanine76985-09-6

Elsewhere

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