Basic information
- CAS
67961-70-0- Standard SMILES
CCNC(=O)Nc1ccccc1C- InChIKey
NSRJDXXKOSLQKG-UHFFFAOYSA-N- Molecular formula
- C10H14N2O
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.11061307
Names & identifiers
- Preferred name
- 1-Ethyl-3-(O-tolyl)urea
- IUPAC
- 1-ethyl-3-(2-methylphenyl)urea
- English name
- 1-Ethyl-3-(o-tolyl)urea
- Molecular formula
- C10H14N2O
- Molecular weight
- 178.23
Names & synonyms
1-ethyl-3-(o-tolyl)ureaRefChem:43243567961-70-0667-326-91-Ethyl-3-o-tolylureaSCHEMBL2104343SCHEMBL11911371N-ethyl-N'-(2-methylphenyl)ureaAKOS002979684
Database identifiers
- CAS
67961-70-0- PubChem CID
- 458045
- EC Number
- 667-326-9
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Melting point
- 66 °C · 66 °C
- Boiling point
- 272 °C · 272 °C
- Density
- 1.086 · 1.086±0.06 g/cm3(Predicted)
- pka
- 14.16 · 14.16±0.46(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
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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