1-Tert-butyl-3-(2-chlorobenzyl)urea
Basic information
- CAS
5768-95-6- Standard SMILES
CC(C)(C)NC(=O)NCc1ccccc1Cl- InChIKey
JLNOQDXNOCSEPU-UHFFFAOYSA-N- Molecular formula
- C12H17ClN2O
- Average molar mass
- 240.73 g/mol
- Monoisotopic mass
- 240.1029409
Names & identifiers
- Preferred name
- 1-Tert-butyl-3-(2-chlorobenzyl)urea
- IUPAC
- 1-tert-butyl-3-[(2-chlorophenyl)methyl]urea
Names & synonyms
ST030740N-tert-Butyl-N'-[(2-chlorophenyl)methyl]urea5768-95-6NSC2042811-TERT-BUTYL-3-(2-CHLOROBENZYL)UREADTXSID90308466AKOS003809509NSC-204281N-(tert-butyl){[(2-chlorophenyl)methyl]amino}carboxamide
Database identifiers
- CAS
5768-95-6- PubChem CID
- 306596
- DTXSID
DTXSID90308466
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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