3-Cyclohexyl-1,1-bis(prop-2-enyl)urea
Basic information
- CAS
76958-91-3- Standard SMILES
C=CCN(CC=C)C(=O)NC1CCCCC1- InChIKey
XPIAAFPDZJIJKC-UHFFFAOYSA-N- Molecular formula
- C13H22N2O
- Average molar mass
- 222.33 g/mol
- Monoisotopic mass
- 222.17321333
Overview
See also: 3-Cyclohexyl-1,1-diallylurea (annotation moved to).
Names & identifiers
- Preferred name
- 3-Cyclohexyl-1,1-bis(prop-2-enyl)urea
- IUPAC
- 3-cyclohexyl-1,1-bis(prop-2-enyl)urea
- English name
- 3-Cyclohexyl-1,1-diallylurea
- Molecular formula
- C13H22N2O
- Molecular weight
- 222.33
Names & synonyms
76958-91-33-cyclohexyl-1,1-bis(prop-2-enyl)ureaN,N-diallyl-N'-cyclohexylurea1,1-Diallyl-3-cyclohexylureaAN-329/42607704N,N-Diallyl-N//'-cyclohexylureaSCHEMBL11444509DTXSID20357467STL069136AKOS0004982343-cyclohexyl-1,1-diprop-2-en-1-ylurea(diprop-2-enylamino)-N-cyclohexylcarboxamide
Show more names
3-Cyclohexyl-1,1-diallylureaUrea, N'-cyclohexyl-N,N-di-2-propen-1-yl-
N'-Cyclohexyl-N,N-di(prop-2-en-1-yl)ureaST45045808ST50526279
Database identifiers
- CAS
76958-91-3- PubChem CID
- 853663
- DTXSID
DTXSID20357467
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…