Basic information
- CAS
81777-77-7- Standard SMILES
CN(O)C(=O)C(C)(C)CCl- InChIKey
KVJBTTMAJUETGB-UHFFFAOYSA-N- Molecular formula
- C6H12ClNO2
- Average molar mass
- 165.62 g/mol
- Monoisotopic mass
- 165.0556563
Names & identifiers
- Preferred name
- 3-chloro-N-hydroxy-N,2,2-trimethylpropanamide
- IUPAC
- 3-chloro-N-hydroxy-N,2,2-trimethylpropanamide
Names & synonyms
3-chloro-N-hydroxy-N,2,2-trimethylpropanamide81777-77-7SCHEMBL7617832DTXSID20526116AKOS006375068
Database identifiers
- CAS
81777-77-7- PubChem CID
- 13192519
- DTXSID
DTXSID20526116
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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