4,4'-(1,4-Phenylenedioxy)bisphthalic Anhydride

C₂₂H₁₀O₈CAS 17828-53-4402.31 g/mol

Open in Covalent MOL file

Acid anhydride Ether

Properties

Molecular formula: C₂₂H₁₀O₈
Molar mass: 402.31 g/mol
Exact mass: 402.0376 Da
logP: 3.89Crippen estimate
Polar surface area: 105.2 Å²
H-bond donors / acceptors: 0 / 8
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

17828-53-4

SMILES

C1=CC(=CC=C1OC2=CC3=C(C=C2)C(=O)OC3=O)OC4=CC5=C(C=C4)C(=O)OC5=O

InChIKey

BBTGUNMUUYNPLH-UHFFFAOYSA-N

InChI

InChI=1S/C22H10O8/c23-19-15-7-5-13(9-17(15)21(25)29-19)27-11-1-2-12(4-3-11)28-14-6-8-16-18(10-14)22(26)30-20(16)24/h1-10H

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Names and synonyms

1 names

Hqda

Work with 4,4'-(1,4-Phenylenedioxy)bisphthalic Anhydride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,4'-Oxydiphthalic anhydride1823-59-296 % similar 2,2-Bis(4-(3,4-dicarboxyphenoxy)phenyl)propane dianhydride38103-06-973 % similar Bis[(3,4-dicarboxylic anhydride) phenyl]terephthalate21117-79-365 % similar 3,4'-Oxydiphthalic anhydride50662-95-863 % similar 5,5'-Bi-2-benzofuran-1,1',3,3'-tetrone2420-87-361 % similar 4-Chlorophthalic anhydride118-45-655 % similar 4-Methylphthalic anhydride19438-61-055 % similar 4,4'-Carbonyldiphthalic anhydride2421-28-555 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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