1,3,4-Thiadiazol-2-amine, 5-propoxy-
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Basic information
- CAS
16784-24-0- Standard SMILES
CCCOc1nnc(N)s1- InChIKey
ZQWRZVFWBDLVBP-UHFFFAOYSA-N- Molecular formula
- C5H9N3OS
- Average molar mass
- 159.21 g/mol
- Monoisotopic mass
- 159.04663309
Names & identifiers
- Preferred name
- 1,3,4-Thiadiazol-2-amine, 5-propoxy-
- IUPAC
- 5-propoxy-1,3,4-thiadiazol-2-amine
- English name
- 1,3,4-Thiadiazol-2-amine, 5-propoxy-
- Molecular formula
- C5H9N3OS
- Molecular weight
- 159.21
Names & synonyms
5-Propoxy-1,3,4-thiadiazol-2-amine1,3,4-Thiadiazol-2-amine, 5-propoxy-16784-24-02-Amino-5-n-propoxy-1,3,4-thiadiazole2-Amino-5-n-propoxy-1,3,4-thiadiazole [French]DTXSID70168404RefChem:217018DTXCID40908951,3,4-Thiadiazole, 2-amino-5-propoxy-(7CI,8CI)1,3,4-Thiadiazol-2-amine, 5-propoxy-SCHEMBL115540891,3,4-Thiadiazole, 2-amino-5-propoxy-
Show more names
DB-278784I83261
Database identifiers
- CAS
16784-24-0- PubChem CID
- 204673
- DTXSID
DTXSID70168404
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Melting point
- 171 · 171-173 °C(Solv: water (7732-18-5))
- Boiling point
- 275.2 · 275.2±23.0 °C(Predicted)
- Density
- 1.277 · 1.277±0.06 g/cm3(Predicted)
- pka
- 4.42 · 4.42±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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