L-Cysteine, N-acetyl-S-(2-nitrophenyl)-
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Basic information
- CAS
91088-54-9- Standard SMILES
CC(=O)N[C@@H](CSc1ccccc1[N+](=O)[O-])C(=O)O- InChIKey
QEQRFMFIQJLURW-QMMMGPOBSA-N- Molecular formula
- C11H12N2O5S
- Average molar mass
- 284.29 g/mol
- Monoisotopic mass
- 284.04669248
Names & identifiers
- Preferred name
- L-Cysteine, N-acetyl-S-(2-nitrophenyl)-
- IUPAC
- (2R)-2-acetamido-3-(2-nitrophenyl)sulfanylpropanoic acid
Names & synonyms
91088-54-9L-Cysteine, N-acetyl-S-(2-nitrophenyl)-SCHEMBL11070847DTXSID20919983QEQRFMFIQJLURW-QMMMGPOBSA-NS-(o-nitrophenyl)-N-acetyl-L-cysteineN-(1-Hydroxyethylidene)-S-(2-nitrophenyl)cysteineN-(1-Hydroxyethylidene)-S-(2-nitrophenyl)-L-cysteine
Database identifiers
- CAS
91088-54-9- PubChem CID
- 185068
- DTXSID
DTXSID20919983
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 357
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Related reactions
2 records
Compound notes
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