3-(3-Chlorophenyl)-1-cyclohexyl-1-methylurea
Basic information
- CAS
82744-88-5- Standard SMILES
CN(C(=O)Nc1cccc(Cl)c1)C1CCCCC1- InChIKey
LRYHVCLGCXYSBI-UHFFFAOYSA-N- Molecular formula
- C14H19ClN2O
- Average molar mass
- 266.76 g/mol
- Monoisotopic mass
- 266.1185909
Names & identifiers
- Preferred name
- 3-(3-Chlorophenyl)-1-cyclohexyl-1-methylurea
- IUPAC
- 3-(3-chlorophenyl)-1-cyclohexyl-1-methylurea
- English name
- 3-(3-Chlorophenyl)-1-cyclohexyl-1-methylurea
- Molecular formula
- C14H19ClN2O
- Molecular weight
- 266.77
Names & synonyms
3-(3-chlorophenyl)-1-cyclohexyl-1-methylurea82744-88-5DTXSID10357471RefChem:274134DTXCID20308530665-648-4N'-(3-chlorophenyl)-N-cyclohexyl-N-methylureaSTL069124AKOS000498369ST45045615AN-329/40316736[(3-chlorophenyl)amino]-N-cyclohexyl-N-methylcarboxamide
Show more names
Urea, N'-(3-chlorophenyl)-N-cyclohexyl-N-methyl-
Database identifiers
- CAS
82744-88-5- PubChem CID
- 853673
- DTXSID
DTXSID10357471- EC Number
- 665-648-4
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- Boiling point
- 435.7 · 435.7±37.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 14.37 · 14.37±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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, P280, P305+P351+P338, and P337+P317 (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.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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