1-(2-Methoxyethyl)-1H,1'H-2,2'-biimidazole
Basic information
- CAS
37570-86-8- Standard SMILES
COCCn1ccnc1-c1ncc[nH]1- InChIKey
AAIBRWXIGYVUQP-UHFFFAOYSA-N- Molecular formula
- C9H12N4O
- Average molar mass
- 192.22 g/mol
- Monoisotopic mass
- 192.10111102
Names & identifiers
- Preferred name
- 1-(2-Methoxyethyl)-1H,1'H-2,2'-biimidazole
- IUPAC
- 2-(1H-imidazol-2-yl)-1-(2-methoxyethyl)imidazole
Names & synonyms
DTXSID00128071037570-86-81-(2-Methoxyethyl)-1H,1'H-2,2'-biimidazole1-(2-Methoxyethyl)-2,2a(2)-bi-1H-imidazole
Database identifiers
- CAS
37570-86-8- PubChem CID
- 12202016
- DTXSID
DTXSID001280710
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 55.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 178
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Compound notes
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