2-Amino-5,5-dimethyl-thiazol-4-one
Basic information
- CAS
4695-19-6- Standard SMILES
CC1(C)SC(=N)NC1=O- InChIKey
IDALNGXBOPPKGA-UHFFFAOYSA-N- Molecular formula
- C5H8N2OS
- Average molar mass
- 144.2 g/mol
- Monoisotopic mass
- 144.03573406
Overview
See also: 2-Amino-5,5-dimethyl-4,5-dihydro-1,3-thiazol-4-one (preferred).
Names & identifiers
- Preferred name
- 2-Amino-5,5-dimethyl-thiazol-4-one
- IUPAC
- 2-imino-5,5-dimethyl-1,3-thiazolidin-4-one
Names & synonyms
SCHEMBL11050972EAA695192-amino-5,5-dimethyl-thiazol-4-one2-Amino-5,5-dimethylthiazol-4(5H)-oneCS-0239181EN300-207280G53408
Database identifiers
- CAS
4695-19-6- PubChem CID
- 137701547
- Nikkaji
- J24.641G
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 176
Related reactions
2 records
Compound notes
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