Basic information
- CAS
1346697-44-6- Standard SMILES
CCCOc1cn[nH]c(=O)c1Cl- InChIKey
SSJXMGNVMPPQDT-UHFFFAOYSA-N- Molecular formula
- C7H9ClN2O2
- Average molar mass
- 188.61 g/mol
- Monoisotopic mass
- 188.0352552
Names & identifiers
- Preferred name
- 4-chloro-5-propoxypyridazin-3(2H)-one
- IUPAC
- 5-chloro-4-propoxy-1H-pyridazin-6-one
- English name
- 4-chloro-5-propoxypyridazin-3(2H)-one
- Molecular formula
- C7H9ClN2O2
- Molecular weight
- 188.61156
Names & synonyms
4-chloro-5-propoxypyridazin-3(2H)-one1346697-44-64-chloro-5-propoxy-2,3-dihydropyridazin-3-oneDTXSID10856318DB-241790
Database identifiers
- CAS
1346697-44-6- PubChem CID
- 71607366
- DTXSID
DTXSID10856318
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Chemistry & industry
Suppliers1 total
郑州药领医药科技有限公司13526569071 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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