Basic information
- CAS
1613409-20-3- Standard SMILES
CC(=O)N[C@H](CC(=O)OC(C)(C)C)C(=O)O- InChIKey
NKNPTCBHHPHSEA-SSDOTTSWSA-N- Molecular formula
- C10H17NO5
- Average molar mass
- 231.25 g/mol
- Monoisotopic mass
- 231.11067264
Names & identifiers
- Preferred name
- (2R)-4-(tert-butoxy)-2-acetamido-4-oxobutanoic acid
- IUPAC
- (2R)-2-acetamido-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
Names & synonyms
1613409-20-3(2R)-4-(tert-butoxy)-2-acetamido-4-oxobutanoic acidSCHEMBL13259810
Database identifiers
- CAS
1613409-20-3- PubChem CID
- 91553372
- EC Number
- 194-430-7
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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