3-Butenethioamide, N-[2-(ethenyloxy)ethyl]-
Basic information
- CAS
827320-18-3- Standard SMILES
C=CCC(=S)NCCOC=C- InChIKey
OSMLKRRWEBHFAC-UHFFFAOYSA-N- Molecular formula
- C8H13NOS
- Average molar mass
- 171.26 g/mol
- Monoisotopic mass
- 171.07178521
Names & identifiers
- Preferred name
- 3-Butenethioamide, N-[2-(ethenyloxy)ethyl]-
- IUPAC
- N-(2-ethenoxyethyl)but-3-enethioamide
Names & synonyms
3-Butenethioamide, N-[2-(ethenyloxy)ethyl]-827320-18-3DTXSID60478362N-[2-(vinyloxy)ethyl]-3-butenethioamideN-[2-(ETHENYLOXY)ETHYL]BUT-3-ENETHIOAMIDE
Database identifiers
- CAS
827320-18-3- PubChem CID
- 12139999
- DTXSID
DTXSID60478362
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 145
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Compound notes
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