2-Methyl-5-(trifluoromethyl)tetrazole
Basic information
- CAS
768-27-4- Standard SMILES
Cn1nnc(C(F)(F)F)n1- InChIKey
PCQICWDPWODMNF-UHFFFAOYSA-N- Molecular formula
- C3H3F3N4
- Average molar mass
- 152.08 g/mol
- Monoisotopic mass
- 152.0309806
Names & identifiers
- Preferred name
- 2-Methyl-5-(trifluoromethyl)tetrazole
- IUPAC
- 2-methyl-5-(trifluoromethyl)tetrazole
- English name
- 2-Methyl-5-(trifluoromethyl)-2H-tetrazole
- Molecular weight
- 0
Names & synonyms
2-Methyl-5-(trifluoromethyl)tetrazole768-27-42H-Tetrazole, 2-methyl-5-(trifluoromethyl)-DTXSID20301228RefChem:88174DTXCID20252362PCQICWDPWODMNF-UHFFFAOYSA-NNSC1419152-methyl-5-(trifluoromethyl)-2H-tetrazoleSCHEMBL3441191SCHEMBL34411932-methyl-5-trifluoromethylte-trazole
Show more names
NSC-141915DS-0042492-Methyl-5-(trifluoromethyl)-2H-tetraazole #
Database identifiers
- CAS
768-27-4- PubChem CID
- 285144
- DTXSID
DTXSID20301228- Nikkaji
- J100.067E
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 123
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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