2-(4-Chlorophenyl)-2H-phenanthro[9,10-d][1,2,3]triazole
Basic information
- CAS
975-84-8- Standard SMILES
Clc1ccc(-n2nc3c4ccccc4c4ccccc4c3n2)cc1- InChIKey
LYPDMVISHYAILI-UHFFFAOYSA-N- Molecular formula
- C20H12ClN3
- Average molar mass
- 329.8 g/mol
- Monoisotopic mass
- 329.0719751
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)-2H-phenanthro[9,10-d][1,2,3]triazole
- IUPAC
- 2-(4-chlorophenyl)phenanthro[9,10-d]triazole
- English name
- 2-(4-Chlorophenyl)-2H-phenanthro[9,10-d][1,2,3]triazole
- Molecular formula
- C20H12ClN3
- Molecular weight
- 0
Names & synonyms
2-(4-Chlorophenyl)-2H-phenanthro[9,10-d][1,2,3]triazole975-84-82-(p-Chlorophenyl)-2H-phenanthro(9,10-d)triazoleDTXSID20348092LYPDMVISHYAILI-UHFFFAOYSA-N2-(4-Chlorophenyl)-2H-phenanthro[9,10-d][1,2,3]triazole #
Database identifiers
- CAS
975-84-8- PubChem CID
- 630128
- DTXSID
DTXSID20348092- Nikkaji
- J1.427.533I
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 420
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Related reactions
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Compound notes
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