1-(Oxan-2-yl)-1H-1,2,3-benzotriazole
Basic information
- Standard SMILES
c1ccc2c(c1)nnn2C1CCCCO1- InChIKey
LEMXRUFANZFVFB-UHFFFAOYSA-N- Molecular formula
- C11H13N3O
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.10586205
Names & identifiers
- Preferred name
- 1-(Oxan-2-yl)-1H-1,2,3-benzotriazole
- IUPAC
- 1-(oxan-2-yl)benzotriazole
Names & synonyms
22347-81-51-(Oxan-2-yl)-1H-1,2,3-benzotriazole1-(tetrahydro-2H-pyran-2-yl)-1H-benzo[d][1,2,3]triazoleNSC6825541-tetrahydropyran-2-ylbenzotriazole1-(oxan-2-yl)benzotriazolestarbld0031452SCHEMBL806435CHEMBL1971989NSC-682554NCI60_029557F180761
Show more names
1-Tetrahydro-2H-pyran-2-yl-1H-1,2,3-benzotriazole
Database identifiers
- PubChem CID
- 388091
- ChEMBL
CHEMBL1971989- Nikkaji
- J1.087.311H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 224
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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