Basic information
- CAS
133611-97-9- Standard SMILES
COc1cccc(NC(=O)Nc2ccc(Cl)cc2)c1- InChIKey
JSODWGRUZQBMNK-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O2
- Average molar mass
- 276.72 g/mol
- Monoisotopic mass
- 276.0665554
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-3-(3-methoxyphenyl)urea
- IUPAC
- 1-(4-chlorophenyl)-3-(3-methoxyphenyl)urea
Names & synonyms
1-(4-chlorophenyl)-3-(3-methoxyphenyl)urea133611-97-9DTXSID70352624RefChem:225034DTXCID00303689668-963-5N-(4-chlorophenyl)-N'-(3-methoxyphenyl)ureaCambridge id 5375464Oprea1_388945Oprea1_542772SCHEMBL4117269SCHEMBL30469272
Show more names
STK039884AKOS000483647ST040304AB00083362-01SR-01000207429SR-01000207429-1[(4-chlorophenyl)amino]-N-(3-methoxyphenyl)carboxamide
Database identifiers
- CAS
133611-97-9- PubChem CID
- 730368
- DTXSID
DTXSID70352624- EC Number
- 668-963-5
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 293
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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, 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 CategoriesAquatic Acute 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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