Basic information
- CAS
66859-64-1- Standard SMILES
CCN(CC)C(=O)C(CC)(CC)S(=O)(=O)CC- InChIKey
XFTZEGPVTVNRTP-UHFFFAOYSA-N- Molecular formula
- C12H25NO3S
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.15551483
Names & identifiers
- Preferred name
- Butyramide, 2-(ethylsulfonyl)-N,N,2-triethyl-
- IUPAC
- N,N,2-triethyl-2-ethylsulfonylbutanamide
- English name
- 2-(Ethylsulfonyl)-N,N,2-triethylbutyramide
- Molecular formula
- C12H25NO3S
- Molecular weight
- 263.4
Names & synonyms
BRN 18765262-(Ethylsulfonyl)-N,N,2-triethylbutyramide66859-64-1BUTYRAMIDE, 2-(ETHYLSULFONYL)-N,N,2-TRIETHYL-DTXSID90216991RefChem:331145DTXCID201394822-(ethanesulfonyl)-N,N,2-triethylbutanamideButanamide, N,N,2-triethyl-2-(ethylsulfonyl)-
Database identifiers
- CAS
66859-64-1- PubChem CID
- 48208
- DTXSID
DTXSID90216991- Nikkaji
- J65.833B
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- Boiling point
- 408.7 · 408.7±28.0 °C(Predicted)
- Density
- 1.044 · 1.044±0.06 g/cm3(Predicted)
- pka
- -1.16 · -1.16±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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