N-[(Benzyloxy)carbonyl]glutamic acid
Basic information
- CAS
1155-62-0- Standard SMILES
O=C(O)CCC(NC(=O)OCc1ccccc1)C(=O)O- InChIKey
PVFCXMDXBIEMQG-UHFFFAOYSA-N- Molecular formula
- C13H15NO6
- Average molar mass
- 281.26 g/mol
- Monoisotopic mass
- 281.0899372
Names & identifiers
- Preferred name
- N-[(Benzyloxy)carbonyl]glutamic acid
- IUPAC
- 2-(phenylmethoxycarbonylamino)pentanedioic acid
- English name
- Z-DL-GLU-OH
- Molecular formula
- C13H15NO6
- Molecular weight
- 281.26
Names & synonyms
5619-01-2N-[(Benzyloxy)carbonyl]glutamic acidZ-DL-GLU-OHCbz-DL-Glutamic acid2-(phenylmethoxycarbonylamino)pentanedioic acidCbz-Glu-OHN-[(Phenylmethoxy)carbonyl]glutamic acidZ-L-Glutamic acid2-{[(benzyloxy)carbonyl]amino}pentanedioic acid((Benzyloxy)carbonyl)glutamic acidn-benzyloxycarbonyl-dl-glutamic acidNSC-169154
Show more names
Nsc169154CBZ-DL-GLUZ-DL-GLUTAMIC ACIDLABOTEST-BB LT00441015CARBOBENZYLOXY-DL-GLUTAMIC ACIDN-ALPHA-CARBOBENZOXY-DL-GLUTAMIC ACID
Glutamic acid, N-[(phenylmethoxy)carbonyl]-N-Benzyloxycarbonyl-L-glutamic acid2-(((Benzyloxy)carbonyl)amino)pentanedioic acidGlutamic acid, N-benzyl ester, L-2-([(Benzyloxy)carbonyl]amino)pentanedioic acidNSC-555NSC-88494NSC-169149
Database identifiers
- CAS
1155-62-0、5619-01-2、63648-73-7- PubChem CID
- 219352
- ChEMBL
CHEMBL1899104- UNII
- NUF2NC6GQ9
- EC Number
- 214-584-1
- Nikkaji
- J2.716.374B
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Boiling point
- 529.1 · 529.1±50.0 °C(Predicted)
- Density
- 1.36 · 1.360±0.06 g/cm3(Predicted)
- pka
- 3.81 · 3.81±0.10(Predicted)
Chemistry & industry
Applications
UsesN-[(Phenylmethoxy)carbonyl]glutamic Acid, is a building block used in various chemical synthesis. It can be used in the synthesis of f pomalidomide (P688200) and it’s impurities,
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Related reactions
1 records
Compound notes
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