2-Propen-1-one, 1-(2,4-dimethoxyphenyl)-3-(4-pyridinyl)-, (Z)-2-butenedioate (2:1)
Basic information
- CAS
65373-35-5- Standard SMILES
COc1ccc(C(=O)/C=C\c2ccncc2)c(OC)c1.COc1ccc(C(=O)/C=C\c2ccncc2)c(OC)c1.O=C(O)/C=C/C(=O)O- InChIKey
XGRJEEWHDQOFAZ-NWDFUMCASA-N- Molecular formula
- C36H34N2O10
- Average molar mass
- 654.7 g/mol
- Monoisotopic mass
- 654.22134529
Names & identifiers
- Preferred name
- 2-Propen-1-one, 1-(2,4-dimethoxyphenyl)-3-(4-pyridinyl)-, (Z)-2-butenedioate (2:1)
- IUPAC
- (E)-but-2-enedioic acid;bis((Z)-1-(2,4-dimethoxyphenyl)-3-pyridin-4-ylprop-2-en-1-one)
Names & synonyms
2-Propen-1-one, 1-(2,4-dimethoxyphenyl)-3-(4-pyridinyl)-, (Z)-2-butenedioate (2:1)65373-35-5RefChem:10643421-(2,4-Dimethoxyphenyl)-3-(4-pyridinyl)-2-propen-1-one (Z)-2-butenedioate (2:1)Maleate acide de la (dimethoxy-2,4 phenyl)(beta-(pyridyl-4) vinyl)cetone [French]Maleate acide de la (dimethoxy-2,4 phenyl)(beta-(pyridyl-4) vinyl)cetone
Database identifiers
- CAS
65373-35-5- PubChem CID
- 6446754
Properties
Computed structural properties
- Topological polar surface area
- 171 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 12
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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