Urea, 1-(2-bromoethyl)-3-phenyl-
Basic information
- CAS
5157-48-2- Standard SMILES
O=C(NCCBr)Nc1ccccc1- InChIKey
JXTNSWBSWXAYBC-UHFFFAOYSA-N- Molecular formula
- C9H11BrN2O
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 242.00548
Names & identifiers
- Preferred name
- Urea, 1-(2-bromoethyl)-3-phenyl-
- IUPAC
- 1-(2-bromoethyl)-3-phenylurea
Names & synonyms
1-(2-Bromoethyl)-3-phenylurea3-(2-Bromoethyl)-1-phenylurea5157-48-2Urea, 1-(2-bromoethyl)-3-phenyl-NSC 79651BRN 2804754DTXSID401995230-12-00-00349 (Beilstein Handbook Reference)RefChem:387310DTXCID00122014N-(2-bromoethyl)-N'-phenylureaNSC79651
Show more names
SCHEMBL16666836JXTNSWBSWXAYBC-UHFFFAOYSA-N1-(2-bromoethyl)-3-phenyl urea[(2-bromoethyl)amino]-N-benzamideNSC-79651AKOS003587354ST51030810
Database identifiers
- CAS
5157-48-2- PubChem CID
- 96556
- DTXSID
DTXSID40199523- Nikkaji
- J83.814D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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