Ethenamine, 2-(2-thiazolyl)-
Basic information
- CAS
948905-56-4- Standard SMILES
NC=Cc1nccs1- InChIKey
JHFWRROZVDMANI-UHFFFAOYSA-N- Molecular formula
- C5H6N2S
- Average molar mass
- 126.18 g/mol
- Monoisotopic mass
- 126.02516937
Names & identifiers
- Preferred name
- Ethenamine, 2-(2-thiazolyl)-
- IUPAC
- 2-(1,3-thiazol-2-yl)ethenamine
- English name
- Ethenamine, 2-(2-thiazolyl)-
- Molecular formula
- C5H6N2S
- Molecular weight
- 126.18
Names & synonyms
Ethenamine, 2-(2-thiazolyl)-948905-56-4DB-276557(E)-2-(1,3-thiazol-2-yl)ethenamine
Database identifiers
- CAS
948905-56-4- PubChem CID
- 91992658
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 92.4
Physicochemical properties
- Boiling point
- 243.232 · 243.232±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.258 · 1.258±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.532 · 6.532±0.70(predicted)
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Compound notes
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