Boc-D-2-cyanophenylalanine
Properties
- Molecular formula
- C15H18N2O4
- Molar mass
- 290.32 g/mol
- Exact mass
- 290.1267 Da
- logP
- 2.08Crippen estimate
- Polar surface area
- 99.4 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 4
- Stereocentres
- Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
261380-28-3SMILES
CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1C#N)C(=O)OInChIKey
AJHPGXZOIAYYDW-GFCCVEGCSA-NInChI
InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(13(18)19)8-10-6-4-5-7-11(10)9-16/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)/t12-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Boc-2-cyano-D-phenylalanine
Work with Boc-D-2-cyanophenylalanine
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
(2S)-3-(2-Bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid261165-02-071 % similar
Boc-2-methyl-D-phenylalanine80102-29-071 % similar
Boc-2-chloro-L-phenylalanine114873-02-870 % similar
(R)-2-((tert-Butoxycarbonyl)amino)-3-(2-chlorophenyl)propanoic acid80102-23-470 % similar
Boc-L-2-trifluoromethylphe167993-21-767 % similar
Boc-dl-phe-oh4530-18-167 % similar
Boc-D-4,4'-biphenylalanine128779-47-565 % similar
Boc-L-4,4'-biphenylalanine147923-08-865 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds