Basic information
- CAS
78016-03-2- Standard SMILES
O=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccc(Cl)c(Cl)c1- InChIKey
IMDDDJBDFZQNJH-UHFFFAOYSA-N- Molecular formula
- C13H8Cl4N2O
- Average molar mass
- 350 g/mol
- Monoisotopic mass
- 347.939074
Names & identifiers
- Preferred name
- 1-(3,4-Dichloro-phenyl)-3-(3,5-dichloro-phenyl)-urea
- IUPAC
- 1-(3,4-dichlorophenyl)-3-(3,5-dichlorophenyl)urea
- English name
- 1-(3,4-Dichloro-phenyl)-3-(3,5-dichloro-phenyl)-urea
- Molecular formula
- C13H8Cl4N2O
- Molecular weight
- 350.03
Names & synonyms
78016-03-21-(3,4-DICHLORO-PHENYL)-3-(3,5-DICHLORO-PHENYL)-UREARefChem:422755684-933-4CHEMBL255505N-(3,4-dichlorophenyl)-N'-(3,5-dichlorophenyl)ureaCBMicro_019879CCG-8060BDBM50373332AKOS002934710PD178883BIM-0020045.P001
Show more names
Urea, N-(3,4-dichlorophenyl)-N'-(3,5-dichlorophenyl)-
ST50982277N-(3,5-dichlorophenyl)[(3,4-dichlorophenyl)amino]carboxamide
Database identifiers
- CAS
78016-03-2- PubChem CID
- 989142
- ChEMBL
CHEMBL255505- EC Number
- 684-933-4
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 334
Physicochemical properties
- Melting point
- 248 · 248-249 °C
- Boiling point
- 366.2 · 366.2±42.0 °C(Predicted)
- Density
- 1.608 · 1.608±0.06 g/cm3(Predicted)
- pka
- 12.52 · 12.52±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P273-P391-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
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
- H410-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P273-P391-P501
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
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