Basic information
- CAS
41117-59-3- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](CSCC(N)=O)C(=O)O- InChIKey
IDMKXHYUDWFPKX-LURJTMIESA-N- Molecular formula
- C10H18N2O5S
- Average molar mass
- 278.33 g/mol
- Monoisotopic mass
- 278.09364285
Names & identifiers
- Preferred name
- S-(2-Amino-2-oxoethyl)-N-(tert-butoxycarbonyl)-L-cysteine
- IUPAC
- (2R)-3-(2-amino-2-oxoethyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Names & synonyms
41117-59-3DTXSID80785646S-(2-Amino-2-oxoethyl)-N-(tert-butoxycarbonyl)-L-cysteine(R)-3-((2-Amino-2-oxoethyl)thio)-2-((tert-butoxycarbonyl)amino)propanoic acid
Database identifiers
- CAS
41117-59-3- PubChem CID
- 71362002
- DTXSID
DTXSID80785646
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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