Tetrazolo(1,5-b)pyridazine, 6,8-diphenyl-
Basic information
- CAS
130187-50-7- Standard SMILES
c1ccc(-c2cc(-c3ccccc3)c3nnnn3n2)cc1- InChIKey
RZTXJKNPZWBOQX-UHFFFAOYSA-N- Molecular formula
- C16H11N5
- Average molar mass
- 273.29 g/mol
- Monoisotopic mass
- 273.10144537
Names & identifiers
- Preferred name
- Tetrazolo(1,5-b)pyridazine, 6,8-diphenyl-
- IUPAC
- 6,8-diphenyltetrazolo[1,5-b]pyridazine
Names & synonyms
Tetrazolo(1,5-b)pyridazine, 6,8-diphenyl-BRN 3618734130187-50-76,8-Diphenyltetrazolo(1,5-b)pyridazineDTXSID701563866,8-diphenyltetrazolo[1,5-b]pyridazineRefChem:384316DTXCID0078877
Database identifiers
- CAS
130187-50-7- PubChem CID
- 3076097
- DTXSID
DTXSID70156386- Nikkaji
- J314.083K
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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