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Basic information
- CAS
477854-50-5- Standard SMILES
CCOC(=O)c1cnc(-c2ccccc2)nc1Sc1ccccc1- InChIKey
UOKBQRHASFNSSP-UHFFFAOYSA-N- Molecular formula
- C19H16N2O2S
- Average molar mass
- 336.416 g/mol
- Monoisotopic mass
- 336.09324875
Names & identifiers
- Preferred name
- Ethyl 2-phenyl-4-(phenylthio)-5-pyrimidinecarboxylate
- IUPAC
- Ethyl 2-phenyl-4-(phenylsulfanyl)pyrimidine-5-carboxylate
- English name
- ETHYL 2-PHENYL-4-(PHENYLSULFANYL)-5-PYRIMIDINECARBOXYLATE
- Molecular formula
- C19H16N2O2S
- Molecular weight
- 336.41
Names & synonyms
ETHYL 2-PHENYL-4-(PHENYLSULFANYL)-5-PYRIMIDINECARBOXYLATE5-Pyrimidinecarboxylic acid, 2-phenyl-4-(phenylthio)-, ethyl ester
Database identifiers
- CAS
477854-50-5- PubChem CID
- 1474597
- DTXSID
DTXSID901214112
Properties
Physicochemical properties
- Boiling point
- 421.3 · 421.3±37.0 °C(Predicted)
- Density
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- pka
- 0.36 · 0.36±0.29(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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