Ethanone, 2-amino-1-(2-thiazolyl)-
Basic information
- CAS
153720-01-5- Standard SMILES
NCC(=O)c1nccs1- InChIKey
UTRBRLNTLFCYCH-UHFFFAOYSA-N- Molecular formula
- C5H6N2OS
- Average molar mass
- 142.18 g/mol
- Monoisotopic mass
- 142.02008399
Names & identifiers
- Preferred name
- Ethanone, 2-amino-1-(2-thiazolyl)-
- IUPAC
- 2-amino-1-(1,3-thiazol-2-yl)ethanone
- English name
- Ethanone, 2-amino-1-(2-thiazolyl)-
- Molecular formula
- C5H6N2OS
- Molecular weight
- 142.18
Names & synonyms
153720-01-5Ethanone, 2-amino-1-(2-thiazolyl)-RefChem:3414062-Amino-1-(thiazol-2-yl)ethanone2-Amino-1-(thiazol-2-yl)ethan-1-one2-amino-1-(1,3-thiazol-2-yl)ethanoneEthanone, 2-amino-1-(2-thiazolyl)-2-Amino-1-thiazol-2-yl-ethanone2-amino-1-(1,3-thiazol-2-yl)ethan-1-oneglycyl-thiazoleSCHEMBL13116460DTXSID101295940
Show more names
CS-0290780EN300-799824
Database identifiers
- CAS
153720-01-5- PubChem CID
- 45121815
- DTXSID
DTXSID101295940
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 118
Physicochemical properties
- Boiling point
- 261.6 · 261.6±42.0 °C(Predicted)
- Density
- 1.324 · 1.324±0.06 g/cm3(Predicted)
- pka
- 6.16 · 6.16±0.29(Predicted)
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Compound notes
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