Bis[(Z)-3-(2,4-dimethoxyphenyl)-2-butenoic acid]magnesium salt

HCID 33269

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Basic information

CAS: 26011-83-6
Standard SMILES: COc1ccc(C(C)=CC(=O)[O-])c(OC)c1.COc1ccc(C(C)=CC(=O)[O-])c(OC)c1.[Mg+2]
InChIKey: NRMWCJKNPLZLMY-UHFFFAOYSA-L
Molecular formula: C24H26MgO8
Average molar mass: 466.8 g/mol
Monoisotopic mass: 466.1478095

Names & identifiers

Preferred name: Bis[(Z)-3-(2,4-dimethoxyphenyl)-2-butenoic acid]magnesium salt
IUPAC: magnesium bis(3-(2,4-dimethoxyphenyl)but-2-enoate)

Names & synonyms

Bis[(Z)-3-(2,4-dimethoxyphenyl)-2-butenoic acid]magnesium saltDTXSID301362250NS000842012-Butenoic acid, 3-(2,4-dimethoxyphenyl)-, magnesium salt (2:1)

Database identifiers

CAS: 26011-83-6
PubChem CID: 33269
DTXSID: DTXSID301362250

Properties

Computed structural properties

Topological polar surface area: 117 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 8
Rotatable bonds: 6
Heavy atoms: 33
Formal charge: 0
Complexity: 267

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