Boc-D-4-nitrophe
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
- 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
61280-75-9SMILES
CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OInChIKey
XBQADBXCNQPHHY-LLVKDONJSA-NInChI
InChI=1S/C14H18N2O6/c1-14(2,3)22-13(19)15-11(12(17)18)8-9-4-6-10(7-5-9)16(20)21/h4-7,11H,8H2,1-3H3,(H,15,19)(H,17,18)/t11-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Boc-4-nitro-D-phenylalanine
Work with Boc-D-4-nitrophe
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-D-tyr-oh70642-86-371 % similar
Boc-dl-phe-oh4530-18-169 % similar
(S)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid127106-71-268 % similar
Boc-(R)-3-amino-4-(4-nitro-phenyl)-butyric acid219297-12-868 % similar
Boc-4-iodo-D-phenylalanine176199-35-268 % similar
Boc-L-4-fluorophe41153-30-468 % similar
(2S)-2-[(2-Methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid47375-34-868 % similar
Boc-4-amino-L-phenylalanine55533-24-968 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds