2-Bromomethyl-5-ethoxy-1,3,4-thiadiazole
Basic information
- Standard SMILES
CCOc1nnc(CBr)s1- InChIKey
MZNDJEFLUDIBSE-UHFFFAOYSA-N- Molecular formula
- C5H7BrN2OS
- Average molar mass
- 223.09 g/mol
Names & identifiers
- Preferred name
- 2-Bromomethyl-5-ethoxy-1,3,4-thiadiazole
- IUPAC
- 2-(bromomethyl)-5-ethoxy-1,3,4-thiadiazole
Names & synonyms
SCHEMBL10368637MZNDJEFLUDIBSE-UHFFFAOYSA-N2-bromomethyl-5-ethoxy-1,3,4-thiadiazole
Database identifiers
- PubChem CID
- 20153392
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 106
Related reactions
1 records
Compound notes
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