5-Methyl-1-phenyl-1H-tetrazole
Basic information
- CAS
14213-16-2- Standard SMILES
Cc1nnnn1-c1ccccc1- InChIKey
QYSASSWEUXOZEQ-UHFFFAOYSA-N- Molecular formula
- C8H8N4
- Average molar mass
- 160.18 g/mol
- Monoisotopic mass
- 160.07489627
Names & identifiers
- Preferred name
- 5-Methyl-1-phenyl-1H-tetrazole
- IUPAC
- 5-methyl-1-phenyltetrazole
Names & synonyms
5-Methyl-1-phenyl-1H-tetrazole1H-Tetrazole, 5-methyl-1-phenyl-5-methyl-1-phenyltetrazole14213-16-20I4K9S59N8NSC-23235DTXSID60931361RefChem:1073081DTXCID4013600711-Phenyl-5-methyltetrazole2-Phenyl-5-methyltetrazoleTT-21
Show more names
NSC 23235BRN 0130926NSC2323522706-20-35-26-11-00080 (Beilstein Handbook Reference)SCHEMBL323573UNII-0I4K9S59N8SCHEMBL1569907
Database identifiers
- CAS
14213-16-2、22706-20-3- PubChem CID
- 95204
- DTXSID
DTXSID60931361- UNII
- 0I4K9S59N8
- Nikkaji
- J2.158.147J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 144
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…