Basic information
- CAS
13208-27-0- Standard SMILES
O=C(NCc1ccccc1)Nc1cccc(Cl)c1- InChIKey
BEWJVMWOMDSJLP-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O
- Average molar mass
- 260.72 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-3-(3-chlorophenyl)urea
- IUPAC
- 1-benzyl-3-(3-chlorophenyl)urea
Names & synonyms
1-benzyl-3-(3-chlorophenyl)urea13208-27-0RefChem:429825667-613-9N-Benzyl-N'-(3-chlorophenyl)ureaCBDivE_015283SCHEMBL7423285STK005213AKOS003048085N-Benzyl-N'-(3-chlorophenyl)urea #Urea, 1-benzyl-3-(3-chlorophenyl)-
Database identifiers
- CAS
13208-27-0- PubChem CID
- 581390
- EC Number
- 667-613-9
- Nikkaji
- J418.117D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 267
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
4 records
Compound notes
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