2-[(Z)-but-2-enyl]sulfanyl-2-methylpropanamide
Basic information
- CAS
90204-57-2- Standard SMILES
C/C=C\CSC(C)(C)C(N)=O- InChIKey
BSAHSYOMLZNDJT-PLNGDYQASA-N- Molecular formula
- C8H15NOS
- Average molar mass
- 173.28 g/mol
- Monoisotopic mass
- 173.08743528
Names & identifiers
- Preferred name
- 2-[(Z)-but-2-enyl]sulfanyl-2-methylpropanamide
- IUPAC
- 2-[(Z)-but-2-enyl]sulfanyl-2-methylpropanamide
Names & synonyms
NSC3789190204-57-2DTXSID70417964NSC-378912-{[(2Z)-But-2-en-1-yl]sulfanyl}-2-methylpropanamide
Database identifiers
- CAS
90204-57-2- PubChem CID
- 5355484
- DTXSID
DTXSID70417964
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
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Compound notes
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