5-(2-methoxyethyl)-1,3,4-thiadiazol-2(3H)-one
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Basic information
- CAS
84352-78-3- Standard SMILES
COCCc1n[nH]c(=O)s1- InChIKey
IJDFNVIRWAZFRX-UHFFFAOYSA-N- Molecular formula
- C5H8N2O2S
- Average molar mass
- 160.2 g/mol
- Monoisotopic mass
- 160.03064868
Names & identifiers
- Preferred name
- 5-(2-methoxyethyl)-1,3,4-thiadiazol-2(3H)-one
- IUPAC
- 5-(2-methoxyethyl)-3H-1,3,4-thiadiazol-2-one
- English name
- 1,3,4-Thiadiazol-2(3H)-one, 5-(2-methoxyethyl)-
- Molecular formula
- C5H8N2O2S
- Molecular weight
- 0
Names & synonyms
5-(2-methoxyethyl)-1,3,4-thiadiazol-2(3H)-one84352-78-31,3,4-Thiadiazol-2(3H)-one, 5-(2-methoxyethyl)-DB-267399
Database identifiers
- CAS
84352-78-3- PubChem CID
- 45123460
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
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Compound notes
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