Basic information
- CAS
63668-36-0- Standard SMILES
O=C(NCCCl)NCc1ccccc1- InChIKey
CNQHZLLOIIQGKB-UHFFFAOYSA-N- Molecular formula
- C10H13ClN2O
- Average molar mass
- 212.67 g/mol
- Monoisotopic mass
- 212.0716407
Names & identifiers
- Preferred name
- Urea, 1-benzyl-3-(2-chloroethyl)-
- IUPAC
- 1-benzyl-3-(2-chloroethyl)urea
Names & synonyms
Urea, 1-benzyl-3-(2-chloroethyl)-63668-36-0DTXSID90213046RefChem:1100778DTXCID901355371-(2-Chloroethyl)-3-benzylureaBRN 2369809NSC162260SCHEMBL1789096CHEMBL1990329SCHEMBL27673646N-Benzyl-N'-(2-chloroethyl)urea
Show more names
AKOS000567074NSC 162260NSC-162260NCI60_001211
Database identifiers
- CAS
63668-36-0- PubChem CID
- 98726
- DTXSID
DTXSID90213046- ChEMBL
CHEMBL1990329- Nikkaji
- J83.758J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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