Phenol, 2-(5-methyl-1H-1,2,4-triazol-3-yl)-
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Basic information
- CAS
65483-93-4- Standard SMILES
Cc1nc(-c2ccccc2O)n[nH]1- InChIKey
SHNXAWZGPBNDKO-UHFFFAOYSA-N- Molecular formula
- C9H9N3O
- Average molar mass
- 175.19 g/mol
- Monoisotopic mass
- 175.07456192
Names & identifiers
- Preferred name
- Phenol, 2-(5-methyl-1H-1,2,4-triazol-3-yl)-
- IUPAC
- 2-(5-methyl-1H-1,2,4-triazol-3-yl)phenol
- English name
- 2-(5-methyl-1H-[1,2,4]triazol-3-yl)-phenol
- Molecular formula
- C9H9N3O
- Molecular weight
- 175.19
Names & synonyms
65483-93-42-(3-methyl-1H-1,2,4-triazol-5-yl)phenol2-(5-methyl-1H-[1,2,4]triazol-3-yl)-phenolPhenol, 2-(5-methyl-1H-1,2,4-triazol-3-yl)-Enamine_0011202-(5-methyl-4H-1,2,4-triazol-3-yl)phenolSCHEMBL7673129DTXSID20425291HMS1397C20AKOS001025153WAY-601637DB-391519
Show more names
Phenol, 2-(3-methyl-1H-1,2,4-triazol-5-yl)-
Z567915786-(5-Methyl-1,2-dihydro-3H-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
65483-93-4- PubChem CID
- 854940
- DTXSID
DTXSID20425291
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
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Compound notes
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