Basic information
- CAS
303091-95-4- Standard SMILES
CCCC(C)NC(=O)NC1CCCCC1- InChIKey
FJQRSEXWVWHZQL-UHFFFAOYSA-N- Molecular formula
- C12H24N2O
- Average molar mass
- 212.33 g/mol
- Monoisotopic mass
- 212.18886339
Names & identifiers
- Preferred name
- N-Cyclohexyl-N'-(1-methylbutyl)urea
- IUPAC
- 1-cyclohexyl-3-pentan-2-ylurea
Names & synonyms
N-CYCLOHEXYL-N'-(1-METHYLBUTYL)UREARefChem:829579303091-95-4652-992-5AKOS024344462
Database identifiers
- CAS
303091-95-4- PubChem CID
- 4567906
- EC Number
- 652-992-5
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 188
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 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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