Basic information
- CAS
134419-55-9- Standard SMILES
OC(CNC1COCCC1Br)Cn1ccnc1- InChIKey
WCYCMIBIUCLDSU-UHFFFAOYSA-N- Molecular formula
- C11H18BrN3O2
- Average molar mass
- 304.18 g/mol
- Monoisotopic mass
- 303.05824
Names & identifiers
- Preferred name
- 1-[(4-Bromooxan-3-yl)amino]-3-imidazol-1-ylpropan-2-ol
- IUPAC
- 1-[(4-bromooxan-3-yl)amino]-3-imidazol-1-ylpropan-2-ol
Database identifiers
- CAS
134419-55-9- PubChem CID
- 86235
- DTXSID
DTXSID10874254
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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