1-Chloro-3-(4-iodo-2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol
Basic information
- CAS
16781-81-0- Standard SMILES
Cc1nc(I)c([N+](=O)[O-])n1CC(O)CCl- InChIKey
ZRFRHNXTIRSYSG-UHFFFAOYSA-N- Molecular formula
- C7H9ClIN3O3
- Average molar mass
- 345.52 g/mol
- Monoisotopic mass
- 344.93772
Names & identifiers
- Preferred name
- 1-Chloro-3-(4-iodo-2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol
- IUPAC
- 1-chloro-3-(4-iodo-2-methyl-5-nitroimidazol-1-yl)propan-2-ol
Names & synonyms
16781-81-0DTXSID709373941-chloro-3-(4-iodo-2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-olRefChem:1055241DTXCID601365958BRN 06182631-(3-Chloro-2-hydroxypropyl)-4-iodo-2-methyl-5-nitroimidazole1H-Imidazole-1-ethanol, alpha-(chloromethyl)-5-iodo-2-methyl-4-nitro-SCHEMBL6208877
Database identifiers
- CAS
16781-81-0- PubChem CID
- 86065
- DTXSID
DTXSID70937394
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 83.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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