Basic information
- CAS
13142-24-0- Standard SMILES
O=C(Nc1cccc(F)c1)Nc1cc(Cl)ccc1Cl- InChIKey
GAPKFQHTTCOYJR-UHFFFAOYSA-N- Molecular formula
- C13H9Cl2FN2O
- Average molar mass
- 299.12 g/mol
- Monoisotopic mass
- 298.0075965
Names & identifiers
- Preferred name
- 1-(2,5-Dichlorophenyl)-3-(3-fluorophenyl)urea
- IUPAC
- 1-(2,5-dichlorophenyl)-3-(3-fluorophenyl)urea
- English name
- 1-(2,5-Dichlorophenyl)-3-(3-fluorophenyl)urea
- Molecular formula
- C13H9Cl2FN2O
- Molecular weight
- 299.13
Names & synonyms
1-(2,5-dichlorophenyl)-3-(3-fluorophenyl)urea13142-24-0DTXSID90309817RefChem:222923DTXCID80260943661-723-0N-(2,5-dichlorophenyl)-N'-(3-fluorophenyl)ureaNSC216217AKOS024338983NSC-216217Urea, N-(2,5-dichlorophenyl)-N'-(3-fluorophenyl)-
Database identifiers
- CAS
13142-24-0- PubChem CID
- 310985
- DTXSID
DTXSID90309817- EC Number
- 661-723-0
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 319
Physicochemical properties
- Boiling point
- 306.3 · 306.3±42.0 °C(Predicted)
- Density
- 1.511 · 1.511±0.06 g/cm3(Predicted)
- pka
- 12.67 · 12.67±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 319 · H319-H411
- 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.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H319-H411
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
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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