7-Methyl-5H-pyrrolo[1,2-D]tetrazole
Basic information
- CAS
123810-43-5- Standard SMILES
CC1=CCn2nnnc21- InChIKey
BWBGTCHRXFJPBI-UHFFFAOYSA-N- Molecular formula
- C5H6N4
- Average molar mass
- 122.13 g/mol
- Monoisotopic mass
- 122.05924621
Names & identifiers
- Preferred name
- 7-Methyl-5H-pyrrolo[1,2-D]tetrazole
- IUPAC
- 7-methyl-5H-pyrrolo[2,1-e]tetrazole
- English name
- 5H-Pyrrolotetrazole,7-methyl-(9CI)
- Molecular formula
- C5H6N4
- Molecular weight
- 122.12794
Names & synonyms
123810-43-55H-Pyrrolotetrazole,7-methyl-(9CI)7-methyl-5H-pyrrolo[2,1-e]tetrazole7-METHYL-5H-PYRROLO[1,2-D]TETRAZOLEDTXSID00570571
Database identifiers
- CAS
123810-43-5- PubChem CID
- 15257544
- DTXSID
DTXSID00570571- Nikkaji
- J765.003E
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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