1-(3-Chloro-para-tolyl)-urea
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Basic information
- CAS
13142-64-8- Standard SMILES
Cc1ccc(NC(N)=O)cc1Cl- InChIKey
GAFWRUXZGSUTHS-UHFFFAOYSA-N- Molecular formula
- C8H9ClN2O
- Average molar mass
- 184.62 g/mol
- Monoisotopic mass
- 184.0403406
Names & identifiers
- Preferred name
- 1-(3-Chloro-para-tolyl)-urea
- IUPAC
- (3-chloro-4-methylphenyl)urea
- English name
- 1-(3-CHLORO-PARA-TOLYL)-UREA
- Molecular formula
- C8H9ClN2O
- Molecular weight
- 184.62
Names & synonyms
1-(3-CHLORO-PARA-TOLYL)-UREARefChem:423592652-080-71-(3-chloro-4-methylphenyl)urea13142-64-8(3-CHLORO-4-METHYLPHENYL)UREAN-(3-chloro-4-methylphenyl)ureaurea, n-(3-chloro-4-methylphenyl)-3-chloro-4-methylphenylureaNSC211456590393-14-9SCHEMBL3183964
Show more names
(3-chloro-4-methyl-phenyl)ureaDTXSID10274795MFCD00025419STL124160AKOS000158361BS-4005NSC-211456DB-258755
Database identifiers
- CAS
13142-64-8- PubChem CID
- 25741
- DTXSID
DTXSID10274795- EC Number
- 652-080-7
- Nikkaji
- J749.459I
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Boiling point
- 284.4 · 284.4±33.0 °C(Predicted)
- Density
- 1.338 · 1.338±0.06 g/cm3(Predicted)
- pka
- 14.33 · 14.33±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · 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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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