1H-Imidazole-1-ethanol, alpha-(4-chloro-2,3,5,6-tetramethylphenyl)-
Basic information
- CAS
73931-98-3- Standard SMILES
Cc1c(C)c(C(O)Cn2ccnc2)c(C)c(C)c1Cl- InChIKey
VLWKZDMPYTZGCU-UHFFFAOYSA-N- Molecular formula
- C15H19ClN2O
- Average molar mass
- 278.78 g/mol
- Monoisotopic mass
- 278.1185909
Names & identifiers
- Preferred name
- 1H-Imidazole-1-ethanol, alpha-(4-chloro-2,3,5,6-tetramethylphenyl)-
- IUPAC
- 1-(4-chloro-2,3,5,6-tetramethylphenyl)-2-imidazol-1-ylethanol
Names & synonyms
73931-98-31H-Imidazole-1-ethanol, alpha-(4-chloro-2,3,5,6-tetramethylphenyl)-RefChem:1057989alpha-(4-Chloro-2,3,5,6-tetramethylphenyl)-1H-imidazole-1-ethanolSCHEMBL11369555DTXSID409951281-(4-Chloro-2,3,5,6-tetramethylphenyl)-2-(1H-imidazol-1-yl)ethan-1-ol
Database identifiers
- CAS
73931-98-3- PubChem CID
- 206017
- DTXSID
DTXSID40995128
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
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Compound notes
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