Fumaric acid, bis(p-methoxyphenyl) ester

HCID 6434102

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Basic information

CAS: 31263-13-5
Standard SMILES: COc1ccc(OC(=O)/C=C\C(=O)Oc2ccc(OC)cc2)cc1
InChIKey: GMPXJJLSVLCCHM-VAWYXSNFSA-N
Molecular formula: C18H16O6
Average molar mass: 328.3 g/mol
Monoisotopic mass: 328.09468823

Names & identifiers

Preferred name: Fumaric acid, bis(p-methoxyphenyl) ester
IUPAC: bis(4-methoxyphenyl) (Z)-but-2-enedioate
English name: Fumaric acid bis(p-methoxyphenyl) ester
Molecular formula: C18H16O6
Molecular weight: 328.32

Names & synonyms

FUMARIC ACID, BIS(p-METHOXYPHENYL) ESTER31263-13-5RefChem:1085582Di-p-methoxyphenyl fumarateBRN 2163414Butenedioic acid, bis(p-methoxyphenyl) ester, (E)-Fumaric acid bis(p-methoxyphenyl) ester2-Butenedioic acid (2E)-, bis(4-methoxyphenyl) ester (9CI)

Database identifiers

CAS: 31263-13-5
PubChem CID: 6434102

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 71.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 8
Heavy atoms: 24
Formal charge: 0
Complexity: 391

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