Basic information
- CAS
5344-69-4- Standard SMILES
CCCCCCC(C)(C)NC(N)=O- InChIKey
CAFAJXJNVURQRO-UHFFFAOYSA-N- Molecular formula
- C10H22N2O
- Average molar mass
- 186.29 g/mol
- Monoisotopic mass
- 186.17321333
Names & identifiers
- Preferred name
- (1,1-Dimethylheptyl)urea
- IUPAC
- 2-methyloctan-2-ylurea
Names & synonyms
5344-69-4(1,1-DIMETHYLHEPTYL)UREANSC1148DTXSID20968113CAFAJXJNVURQRO-UHFFFAOYSA-NNSC-1148N-(2-Methyloctan-2-yl)carbamimidic acid
Database identifiers
- CAS
5344-69-4- PubChem CID
- 219628
- DTXSID
DTXSID20968113
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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