Basic information
- CAS
64037-68-9- Standard SMILES
C#CCSC(CC)(CC)C(N)=O- InChIKey
IRLPIORIFSVWIM-UHFFFAOYSA-N- Molecular formula
- C9H15NOS
- Average molar mass
- 185.29 g/mol
- Monoisotopic mass
- 185.08743528
Names & identifiers
- Preferred name
- Butyramide, 2-ethyl-2-(2-propynyl)thio-
- IUPAC
- 2-ethyl-2-prop-2-ynylsulfanylbutanamide
- English name
- 2-Ethyl-2-(2-propynylthio)butyramide
- Molecular weight
- 0
Names & synonyms
64037-68-92-Ethyl-2-(2-propynylthio)butyramideBUTYRAMIDE, 2-ETHYL-2-(2-PROPYNYL)THIO-alpha-PropargylmercaptoisobutyramideBRN 18592722-Ethyl-2-(2-propynylmercapto)butyramideAcetamide, 2,2-diethyl-2-(2-propynyl)thio-DTXSID10214055NSC 37890RefChem:331156DTXCID10136546NSC37890
Show more names
Butanamide, 2-ethyl-2-(2-propynylthio)-NSC-37890DB-3139892-Ethyl-2-[(prop-2-yn-1-yl)sulfanyl]butanamide
Database identifiers
- CAS
64037-68-9- PubChem CID
- 46432
- DTXSID
DTXSID10214055- Nikkaji
- J65.832D
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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