Propionamide, 2-(2-butenyl)thio-N,2-dimethyl-
Basic information
- CAS
63915-94-6- Standard SMILES
C/C=C/CSC(C)(C)C(=O)NC- InChIKey
IDYGRQQUWYMRTA-UHFFFAOYSA-N- Molecular formula
- C9H17NOS
- Average molar mass
- 187.3 g/mol
- Monoisotopic mass
- 187.10308534
Names & identifiers
- Preferred name
- Propionamide, 2-(2-butenyl)thio-N,2-dimethyl-
- IUPAC
- 2-[(E)-but-2-enyl]sulfanyl-N,2-dimethylpropanamide
- English name
- 2-[(2-Butenyl)thio]-N,2-dimethylpropionamide
- Molecular formula
- C9H17NOS
- Molecular weight
- 187.3
Names & synonyms
Propionamide, 2-(2-butenyl)thio-N,2-dimethyl-RefChem:109691463915-94-62-(Butenylmercapto)-N-methylisobutyramideBRN 1705690N-Methyl-alpha-crotylmercaptoisobutyramide2-(Butenylthio)-N,2-dimethylpropionamideNSC37892NSC 37892NSC-378922-[(2-Butenyl)thio]-N,2-dimethylpropionamidePropanamide, 2-(2-buten-1-ylthio)-N,2-dimethyl-
Database identifiers
- CAS
63915-94-6- PubChem CID
- 5809019
- Nikkaji
- J87.424H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
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Compound notes
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