Basic information
- CAS
20022-45-1- Standard SMILES
Cc1nc(C)n(CC(O)COc2ccccc2)n1- InChIKey
FCGJOUZMLZOXDX-UHFFFAOYSA-N- Molecular formula
- C13H17N3O2
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.13207679
Names & identifiers
- Preferred name
- 1-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-3-phenoxypropan-2-ol
- IUPAC
- 1-(3,5-dimethyl-1,2,4-triazol-1-yl)-3-phenoxypropan-2-ol
Names & synonyms
1-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-3-phenoxypropan-2-ol20022-45-11-(3,5-DIMETHYL-1,2,4-TRIAZOL-1-YL)-3-PHENOXYPROPAN-2-OLDTXSID401193070AKOS033402626Z15264886783,5-Dimethyl-I+/--(phenoxymethyl)-1H-1,2,4-triazole-1-ethanol
Database identifiers
- CAS
20022-45-1- PubChem CID
- 71908434
- DTXSID
DTXSID401193070
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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