Boc-L-3-nitrophenylalanine
Properties
- Molecular formula
- C14H18N2O6
- Molar mass
- 310.31 g/mol
- Exact mass
- 310.1165 Da
- logP
- 2.12Crippen estimate
- Polar surface area
- 118.8 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 5
- Stereocentres
- Sin SMILES atom order
Hazards
Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Identifiers
CAS number
131980-29-5SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)OInChIKey
OWTGPXDXLMNQKK-NSHDSACASA-NInChI
InChI=1S/C14H18N2O6/c1-14(2,3)22-13(19)15-11(12(17)18)8-9-5-4-6-10(7-9)16(20)21/h4-7,11H,8H2,1-3H3,(H,15,19)(H,17,18)/t11-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Boc-3-nitro-L-phenylalanine
Work with Boc-L-3-nitrophenylalanine
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-3-methyl-L-phenylalanine114873-06-268 % similar
(R)-2-((tert-Butoxycarbonyl)amino)-3-(m-tolyl)propanoic acid114873-14-268 % similar
Boc-3-chloro-D-phenylalanine80102-25-668 % similar
Boc-L-3-bromophenylalanine82278-73-767 % similar
Boc-dl-phe-oh4530-18-167 % similar
Boc-3-(2-naphthyl)-L-alanine58438-04-363 % similar
(2S)-2-(((tert-Butoxy)carbonyl)amino)-3-(3,4-dichlorophenyl)propanoic acid80741-39-563 % similar
Boc-L-4-chlorophe68090-88-060 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds