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Basic information
- CAS
2008-71-1- Standard SMILES
O=C(Nc1ccccc1)Nc1cccc(Cl)c1- InChIKey
BQVXYHYXISZSEZ-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2O
- Average molar mass
- 246.697 g/mol
- Monoisotopic mass
- 246.05599065
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)-3-phenylurea
- IUPAC
- N-(3-Chlorophenyl)-N'-phenylurea
- English name
- 1-(3-Chlorophenyl)-3-phenylurea
- Molecular formula
- C13H11ClN2O
- Molecular weight
- 246.69
Names & synonyms
1-(3-Chlorophenyl)-3-phenylureaN-(3-Chlorophenyl)-N'-phenylureaUrea, N-(3-chlorophenyl)-N'-phenyl-
Database identifiers
- CAS
2008-71-1- PubChem CID
- 295366
- DTXSID
DTXSID60304197- ChEMBL
CHEMBL1524783- EC Number
- 621-413-8
- Nikkaji
- J102.878B
Properties
Physicochemical properties
- Melting point
- 183 · 183-184 °C
- Boiling point
- 289.6 · 289.6±23.0 °C(Predicted)
- Density
- 1.356 · 1.356±0.06 g/cm3(Predicted)
- pka
- 13.78 · 13.78±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H413
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
- H319-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
Uses1-(3-Chlorophenyl)-3-phenylurea is a selective CYP1B1 inhibitor.
Suppliers1 total
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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