Diethyl 5,6-diphenyl-3,4-pyridazinedicarboxylate
Basic information
- CAS
253144-68-2- Standard SMILES
CCOC(=O)c1nnc(-c2ccccc2)c(-c2ccccc2)c1C(=O)OCC- InChIKey
FZPHDBHSGNKLBL-UHFFFAOYSA-N- Molecular formula
- C22H20N2O4
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.14230712
Names & identifiers
- Preferred name
- Diethyl 5,6-diphenyl-3,4-pyridazinedicarboxylate
- IUPAC
- diethyl 5,6-diphenylpyridazine-3,4-dicarboxylate
- English name
- Diethyl 5,6-diphenyl-3,4-pyridazinedicarboxylate
- Molecular formula
- C22H20N2O4
- Molecular weight
- 376.41
Names & synonyms
253144-68-2diethyl 5,6-diphenyl-3,4-pyridazinedicarboxylatediethyl 5,6-diphenylpyridazine-3,4-dicarboxylate3,4-diethyl 5,6-diphenylpyridazine-3,4-dicarboxylateMFCD03001256diethyl 5,6-diphenyl-3,4-pyridazine dicarboxylateDTXSID40423355AKOS005070225CS-0333455diethyl5,6-diphenylpyridazine-3,4-dicarboxylate3R-01845,6-Diphenyl-pyridazine-3,4-dicarboxylic acid diethyl ester
Show more names
3,4-Pyridazinedicarboxylic acid, 5,6-diphenyl-, 3,4-diethyl ester
Database identifiers
- CAS
253144-68-2- PubChem CID
- 6409735
- DTXSID
DTXSID40423355- Nikkaji
- J1.205.455F
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 515
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 114 · 114-116°C
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Compound notes
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