Basic information
- CAS
1762-68-1- Standard SMILES
NC1=NC(=O)C(c2ccccc2)S1- InChIKey
YAMZDYXKCLQXKP-UHFFFAOYSA-N- Molecular formula
- C9H8N2OS
- Average molar mass
- 192.24 g/mol
- Monoisotopic mass
- 192.03573406
Names & identifiers
- Preferred name
- 4-Thiazolidinone, 2-imino-5-phenyl-
- IUPAC
- 2-amino-5-phenyl-1,3-thiazol-4-one
- English name
- 2-amino-5-phenyl-1,3-thiazol-4-one
- Molecular formula
- C9H8N2OS
- Molecular weight
- 192.24
Names & synonyms
1762-68-12-Imino-5-phenyl-1,3-thiazolidin-4-one4-Thiazolidinone, 2-imino-5-phenyl-NSC2520NSC 25204(5H)-Thiazolone, 2-amino-5-phenyl-2-imino-5-phenyl-4-thiazolidinone2-imino-5-phenyl-thiazolidin-4-oneSCHEMBL9798942SCHEMBL111462282-amino-5-phenyl-4-thiazolinoneYAMZDYXKCLQXKP-UHFFFAOYSA-N
Show more names
2-amino-5-phenyl-1,3-thiazol-4-one2-amino-5-phenyl-1,3-thiazol-4(5H)-one
5-phenyl-2-imino-4-thiazolidinoneNSC-2520NSC77632NSC-77632AKOS016368338Z56755652
Database identifiers
- CAS
1762-68-1- PubChem CID
- 220172
- Nikkaji
- J2.054.601H
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Melting point
- 228 · 228-229 °C
- Boiling point
- 365.8 · 365.8±45.0 °C(Predicted)
- Density
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- pka
- 0.03 · 0.03±0.40(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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