Basic information
- CAS
17321-26-5- Standard SMILES
Clc1ccc(OC2CCCCC2)nn1- InChIKey
OJQAWSGLUDQRGU-UHFFFAOYSA-N- Molecular formula
- C10H13ClN2O
- Average molar mass
- 212.67 g/mol
- Monoisotopic mass
- 212.0716407
Names & identifiers
- Preferred name
- 3-Chloro-6-(cyclohexyloxy)pyridazine
- IUPAC
- 3-chloro-6-cyclohexyloxypyridazine
- English name
- 3-chloro-6-(cyclohexyloxy)pyridazine
- Molecular formula
- C10H13ClN2O
- Molecular weight
- 212.68
Names & synonyms
3-chloro-6-(cyclohexyloxy)pyridazine17321-26-53-chloro-6-cyclohexyloxypyridazine3-chloro-6-cyclohexyloxy-pyridazineNSC75072SCHEMBL12949577DTXSID10938340TQP1669NSC-75072AKOS000164035DS-014156Pyridazine, 3-chloro-6-(cyclohexyloxy)-
Database identifiers
- CAS
17321-26-5- PubChem CID
- 252829
- DTXSID
DTXSID10938340
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 106 · 106-108 °C(Solv: ligroine (8032-32-4))
- Boiling point
- 367.6 · 367.6±22.0 °C(Predicted)
- Density
- 1.219 · 1.219±0.06 g/cm3(Predicted)
- pka
- 0.73 · 0.73±0.10(Predicted)
Chemistry & industry
Suppliers1 total
无锡捷化医药科技有限公司83588313 18800520310 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…