Completing data — refresh the page later to see the latest
Basic information
- CAS
1763-78-6- Standard SMILES
O=C(Nc1cccc(C(F)(F)F)c1)Nc1ccc(Cl)c(Cl)c1- InChIKey
ZDCOYULUTBJBBH-UHFFFAOYSA-N- Molecular formula
- C14H9Cl2F3N2O
- Average molar mass
- 349.1 g/mol
- Monoisotopic mass
- 348.0044028
Names & identifiers
- Preferred name
- 1-(3,4-Dichlorophenyl)-3-[3-(trifluoromethyl)phenyl]urea
- IUPAC
- 1-(3,4-dichlorophenyl)-3-[3-(trifluoromethyl)phenyl]urea
- English name
- 1-(3,4-Dichlorophenyl)-3-(3-trifluoromethylphenyl)urea
- Molecular formula
- C14H9Cl2F3N2O
- Molecular weight
- 349.14
Names & synonyms
TCMDC-1242021-(3,4-dichlorophenyl)-3-[3-(trifluoromethyl)phenyl]urea1763-78-6N-(3,4-dichlorophenyl)-N'-[3-(trifluoromethyl)phenyl]ureaNSC102874CBMicro_013122CHEMBL537803SCHEMBL12443228DTXSID10938784ZDCOYULUTBJBBH-UHFFFAOYSA-NSMSF0004187STK416211
Show more names
1-(3,4-Dichlorophenyl)-3-(3-trifluoromethylphenyl)ureaUrea, N-(3,4-dichlorophenyl)-N'-[3-(trifluoromethyl)phenyl]-
AKOS001016416CB03054NSC-102874ST011920BIM-0013238.P001DS-012550Z44589814Urea,n-(3,4-dichlorophenyl)-n-[3-(trifluoromethyl)phenyl]-
Database identifiers
- CAS
1763-78-6- PubChem CID
- 265995
- DTXSID
DTXSID10938784- ChEMBL
CHEMBL537803
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 395
Physicochemical properties
- Boiling point
- 323.8 · 323.8±42.0 °C(Predicted)
- Density
- 1.536 · 1.536±0.06 g/cm3(Predicted)
- pka
- 12.78 · 12.78±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H319
- 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
- H413-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…