Completing data — usually done within a minute
Basic information
- Standard SMILES
Cc1ccc(Sc2c(C=O)c(-c3ccccc3)nn2C)cc1- InChIKey
XESMSCMMPAMZLI-UHFFFAOYSA-N- Molecular formula
- C18H16N2OS
- Average molar mass
- 308.406 g/mol
- Monoisotopic mass
- 308.09833413
Names & identifiers
- Preferred name
- 1-Methyl-5-[(4-methylphenyl)thio]-3-phenyl-1H-pyrazole-4-carboxaldehyde
- IUPAC
- 1-Methyl-5-[(4-methylphenyl)sulfanyl]-3-phenyl-1H-pyrazole-4-carbaldehyde
- English name
- 1-methyl-3-phenyl-5-(p-tolylthio)-1H-pyrazole-4-carbaldehyde
- Molecular formula
- C18H16N2OS
- Molecular weight
- 308.4
Names & synonyms
1-methyl-3-phenyl-5-(p-tolylthio)-1H-pyrazole-4-carbaldehyde1H-Pyrazole-4-carboxaldehyde, 1-methyl-5-[(4-methylphenyl)thio]-3-phenyl-
Database identifiers
- CAS
318233-98-6- PubChem CID
- 2763765
- DTXSID
DTXSID101151007
Properties
Physicochemical properties
- Boiling point
- 494.1 · 494.1±45.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- pka
- -1.07 · -1.07±0.10(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 data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers4 total
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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