Boc-(S)-3-amino-4-(1-naphthyl)-butyric acid
Properties
- Molecular formula
- C19H23NO4
- Molar mass
- 329.40 g/mol
- Exact mass
- 329.1627 Da
- logP
- 3.75Crippen estimate
- Polar surface area
- 75.6 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 5
- Stereocentres
- Sin SMILES atom order
Identifiers
CAS number
219297-09-3SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC2=CC=CC=C21)CC(=O)OInChIKey
JXDXPRAUFACOHG-HNNXBMFYSA-NInChI
InChI=1S/C19H23NO4/c1-19(2,3)24-18(23)20-15(12-17(21)22)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-10,15H,11-12H2,1-3H3,(H,20,23)(H,21,22)/t15-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- (S)-3-((tert-Butoxycarbonyl)amino)-4-(naphthalen-1-yl)butanoic acid
Work with Boc-(S)-3-amino-4-(1-naphthyl)-butyric acid
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.
Similar compounds
Boc-(R)-3-amino-4-(2-chloro-phenyl)-butyric acid218608-93-677 % similar
Boc-(S)-3-Amino-4-(2-chlorophenyl)butyric acid218608-95-877 % similar
Boc-(R)-3-amino-4-(3-benzothienyl)-butyric acid190190-48-871 % similar
Boc-L-beta-homotryptophan229639-48-971 % similar
Boc-(S)-3-amino-4-(3-benzothienyl)-butyric acid270063-45-171 % similar
Boc-(S)-3-amino-4-(2-trifluoromethyl-phenyl)-butyric acid270065-74-271 % similar
Fmoc-(R)-3-amino-4-(1-naphthyl)-butyric acid269398-89-267 % similar
Fmoc-(S)-3-amino-4-(1-naphthyl)-butyric acid270063-38-267 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds