chempirical

D-3-(2-Naphthyl)alanine

C13H13NO2CAS 76985-09-6215.25 g/mol

Open in Covalent MOL file
H2NOHO
Carboxylic acidPrimary 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 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
76985-09-6
SMILES
N[C@H](Cc1ccc2ccccc2c1)C(=O)O
InChIKey
JPZXHKDZASGCLU-GFCCVEGCSA-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)/t12-/m1/s1

Weigh it out

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

Names and synonyms

10 names
  • 2-Naphthalenepropanoic acid, α-amino-, (αR)-
  • 2-Naphthalenepropanoic acid, α-amino-, (R)-
  • (αR)-α-Amino-2-naphthalenepropanoic acid
  • 3-(2-Naphthyl)-D-alanine
  • β-2-Naphthyl-D-alanine
  • D-β-(2-Naphthyl)alanine
  • (R)-2-Amino-3-(naphthalen-2-yl)propanoic acid
  • (2R)-2-Amino-3-(naphthalen-2-yl)propanoic acid
  • (2R)-2-Amino-3-naphthalen-2-ylpropanoic acid
  • 2-Naphthalenepropanoic acid α-amino-, (αR)-

Work with D-3-(2-Naphthyl)alanine

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

Alpha-Amino-2-naphthalenepropanoic acid14108-60-2 2-Naphthylalanine58438-03-2

Elsewhere

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