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Basic information
- Standard SMILES
CC(C)(C)c1ncn(CO)n1- InChIKey
YPXWTGARLLFHPC-UHFFFAOYSA-N- Molecular formula
- C7H13N3O
- Average molar mass
- 155.2 g/mol
- Monoisotopic mass
- 155.10586205
Names & identifiers
- Preferred name
- 3-t-butyl-1H-1,2,4-triazole1-ylmethanol
- IUPAC
- (3-tert-butyl-1,2,4-triazol-1-yl)methanol
Names & synonyms
SCHEMBL3979716YPXWTGARLLFHPC-UHFFFAOYSA-N3-t-butyl-1H-1,2,4-triazole1-ylmethanol
Database identifiers
- PubChem CID
- 57712418
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Related reactions
1 records
Compound notes
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