[(E)-4-(3-bromophenyl)butan-2-ylideneamino]urea
Basic information
- CAS
3506-71-6- Standard SMILES
C/C(CCc1cccc(Br)c1)=N\NC(N)=O- InChIKey
VMSQGBCHISOCIC-RIYZIHGNSA-N- Molecular formula
- C11H14BrN3O
- Average molar mass
- 284.15 g/mol
- Monoisotopic mass
- 283.03202
Names & identifiers
- Preferred name
- [(E)-4-(3-bromophenyl)butan-2-ylideneamino]urea
- IUPAC
- [(E)-4-(3-bromophenyl)butan-2-ylideneamino]urea
Names & synonyms
NSC918563506-71-6DTXSID60418884NSC-91856(2E)-2-[4-(3-Bromophenyl)butan-2-ylidene]hydrazine-1-carboxamide
Database identifiers
- CAS
3506-71-6- PubChem CID
- 5380307
- DTXSID
DTXSID60418884
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…