n-Ethyl-2,2-bis(hydroxymethyl)butanamide
Basic information
- CAS
6970-66-7- Standard SMILES
CCNC(=O)C(CC)(CO)CO- InChIKey
XSBWVNXCDBPILO-UHFFFAOYSA-N- Molecular formula
- C8H17NO3
- Average molar mass
- 175.23 g/mol
- Monoisotopic mass
- 175.1208434
Names & identifiers
- Preferred name
- n-Ethyl-2,2-bis(hydroxymethyl)butanamide
- IUPAC
- N-ethyl-2,2-bis(hydroxymethyl)butanamide
Names & synonyms
n-ethyl-2,2-bis(hydroxymethyl)butanamide6970-66-7NSC 62038NSC62038DTXSID40289579NSC-62038
Database identifiers
- CAS
6970-66-7- PubChem CID
- 247464
- DTXSID
DTXSID40289579
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 143
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Compound notes
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