Basic information
- CAS
242802-84-2- Standard SMILES
COc1ccc(-c2ccc(OC)nn2)cc1- InChIKey
MGFVBMZKYVEROA-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.08987763
Names & identifiers
- Preferred name
- 3-Methoxy-6-(4-methoxyphenyl)pyridazine
- IUPAC
- 3-methoxy-6-(4-methoxyphenyl)pyridazine
- English name
- 3-methoxy-6-(4-methoxyphenyl)pyridazine
- Molecular formula
- C12H12N2O2
- Molecular weight
- 216.24
Names & synonyms
3-methoxy-6-(4-methoxyphenyl)pyridazine242802-84-2DTXSID90572847RefChem:280447DTXCID10523619SCHEMBL25591566SCHEMBL29703893DB-294428Pyridazine, 3-methoxy-6-(4-methoxyphenyl)-
Database identifiers
- CAS
242802-84-2- PubChem CID
- 15445189
- DTXSID
DTXSID90572847- Nikkaji
- J2.315.197I
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 44.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Melting point
- 137 · 137-138 °C
- Boiling point
- 414.8 · 414.8±40.0 °C(Predicted)
- Density
- 1.143 · 1.143±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 2.8 · 2.80±0.10(Predicted)
Chemistry & industry
Suppliers2 total
郑州药领医药科技有限公司13526569071 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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