Basic information
- Standard SMILES
Cc1c(Cl)cccc1-n1nn[nH]c1=O- InChIKey
AVOZPEYUADPVNG-UHFFFAOYSA-N- Molecular formula
- C8H7ClN4O
- Average molar mass
- 210.62 g/mol
Names & identifiers
- Preferred name
- 1-(2-Methyl-3-chlorophenyl)-1,4-dihydrotetrazol-5-one
- IUPAC
- 4-(3-chloro-2-methylphenyl)-1H-tetrazol-5-one
Names & synonyms
SCHEMBL15351683AVOZPEYUADPVNG-UHFFFAOYSA-N1-(2-methyl-3-chlorophenyl)-1,4-dihydrotetrazol-5-one1-(2-methyl-3-chlorophenyl)-1,4-dihydrotetrazole-5-one1-(2-methyl-3-chlorophenyl)-1.4-dihydrotetrazole-5-one
Database identifiers
- PubChem CID
- 136646185
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 270
Related reactions
4 records
Compound notes
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