Basic information
- CAS
66859-63-0- Standard SMILES
CCCSC(CC)(CC)C(N)=O- InChIKey
JUZAKHTUSPDONW-UHFFFAOYSA-N- Molecular formula
- C9H19NOS
- Average molar mass
- 189.32 g/mol
- Monoisotopic mass
- 189.1187354
Names & identifiers
- Preferred name
- Butyramide, 2-ethyl-2-propylthio-
- IUPAC
- 2-ethyl-2-propylsulfanylbutanamide
- English name
- 2-Ethyl-2-(propylthio)butyramide
- Molecular formula
- C9H19NOS
- Molecular weight
- 189.32
Names & synonyms
BUTYRAMIDE, 2-ETHYL-2-PROPYLTHIO-2-Ethyl-2-propylthiobutyramideBRN 185813866859-63-0DTXSID30216990RefChem:331163DTXCID601394812-ethyl-2-(propylsulfanyl)butanamide2-Ethyl-2-(propylthio)butyramideButanamide, 2-ethyl-2-(propylthio)-
Database identifiers
- CAS
66859-63-0- PubChem CID
- 48207
- DTXSID
DTXSID30216990- Nikkaji
- J65.831F
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Density
- 1.0311 · 1.0311 (rough estimate)
- refractive index
- 1.525 · 1.5250 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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