BENZYL ALCOHOL, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-
Basic information
- CAS
75318-77-3- Standard SMILES
COc1cccc(-c2n[nH]c(-c3ccccc3CO)n2)c1- InChIKey
BHBLWLPZKZBBLP-UHFFFAOYSA-N- Molecular formula
- C16H15N3O2
- Average molar mass
- 281.31 g/mol
- Monoisotopic mass
- 281.11642673
Names & identifiers
- Preferred name
- BENZYL ALCOHOL, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-
- IUPAC
- [2-[3-(3-methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]methanol
- English name
- o-[5-(m-Methoxyphenyl)-1H-1,2,4-triazol-3-yl]benzyl alcohol
- Molecular weight
- 0
Names & synonyms
75318-77-3BENZYL ALCOHOL, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-BRN 5584630o-(5-(m-Methoxyphenyl)-s-triazol-3-yl)benzyl alcohol3-(2-(Hydroxymethyl)phenyl)-5-(3-methoxyphenyl)-s-triazoleBenzenemethanol, 2-(5-(3-methoxyphenyl)-1H-1,2,4-triazol-3-yl)-CHEMBL18426SCHEMBL10476810SCHEMBL10943615DTXSID20226280BHBLWLPZKZBBLP-UHFFFAOYSA-N{2-[3-(3-Methoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl}methanol
Show more names
o-[5-(m-Methoxyphenyl)-1H-1,2,4-triazol-3-yl]benzyl alcohol
3-(2-hydroxymethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole5-(2-hydroxymethylphenyl)-3-(3-methoxyphenyl)-1H-1,2,4-triazole
Database identifiers
- CAS
75318-77-3- PubChem CID
- 53228
- DTXSID
DTXSID20226280- ChEMBL
CHEMBL18426- Nikkaji
- J66.015I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 329
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Related reactions
4 records
Compound notes
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