1-Butyl-3-(2-chlorophenyl)-1-phenylurea
Basic information
- CAS
82745-06-0- Standard SMILES
CCCCN(C(=O)Nc1ccccc1Cl)c1ccccc1- InChIKey
JCDSXDAQVQSVGB-UHFFFAOYSA-N- Molecular formula
- C17H19ClN2O
- Average molar mass
- 302.8 g/mol
- Monoisotopic mass
- 302.1185909
Names & identifiers
- Preferred name
- 1-Butyl-3-(2-chlorophenyl)-1-phenylurea
- IUPAC
- 1-butyl-3-(2-chlorophenyl)-1-phenylurea
- English name
- 1-butyl-3-(2-chlorophenyl)-1-phenylurea
- Molecular formula
- C17H19ClN2O
- Molecular weight
- 302.8
Names & synonyms
1-butyl-3-(2-chlorophenyl)-1-phenylurea82745-06-0RefChem:431025667-106-2AKOS024335135N-butyl-N'-(2-chlorophenyl)-N-phenylureaUrea, N-butyl-N'-(2-chlorophenyl)-N-phenyl-
Database identifiers
- CAS
82745-06-0- PubChem CID
- 5083445
- EC Number
- 667-106-2
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- Boiling point
- 464.7 · 464.7±37.0 °C(Predicted)
- Density
- 1.211 · 1.211±0.06 g/cm3(Predicted)
- pka
- 13.57 · 13.57±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H302-H413
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, 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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H317-H302-H413
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…