Basic information
- CAS
20743-49-1- Standard SMILES
Cn1nnc(-c2ccccc2)n1- InChIKey
BARMWGRHJNLIAC-UHFFFAOYSA-N- Molecular formula
- C8H8N4
- Average molar mass
- 160.18 g/mol
- Monoisotopic mass
- 160.07489626
Names & identifiers
- Preferred name
- 2-Methyl-5-phenyl-2H-tetrazole
- IUPAC
- 2-methyl-5-phenyltetrazole
- English name
- 2-methyl-5-phenyl-2h-tetrazole
- Molecular formula
- C8H8N4
- Molecular weight
- 160.18
Names & synonyms
2-Methyl-5-phenyl-2H-tetrazole2-Methyl-5-phenyltetrazole20743-49-12H-Tetrazole, 2-methyl-5-phenyl-2-methyl-5-phenyl-2H-1,2,3,4-tetrazoleNSC-314080NSC314080QWD4NM5XS6SCHEMBL58442-methyl-5-phenyl-tetrazoleSCHEMBL344042SCHEMBL1823663
Show more names
SCHEMBL3043563SCHEMBL5289701DTXSID003173072-Methyl-5-phenyl-2H-tetraazole #AKOS006241416DB-193032InChI=1/C8H8N4/c1-12-10-8(9-11-12)7-5-3-2-4-6-7/h2-6H,1H
Database identifiers
- CAS
20743-49-1- PubChem CID
- 329758
- DTXSID
DTXSID00317307- UNII
- QWD4NM5XS6
- Nikkaji
- J467.701C
Properties
Computed structural properties
- XLogP
- 1.8
- 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
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physicochemical properties
- FDA UNII
- 4 NM5XS6 · QWD4NM5XS6
Chemistry & industry
Suppliers2 total
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
1 records
Compound notes
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