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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 71416632Generated: October 28, 2026

Cyclohexa-2,5-diene-1,4-dione;2,6-dimethoxyphenol

https://huagongshe.com/en/chemical/71416632

Cyclohexa-2,5-diene-1,4-dione;2,6-dimethoxyphenol molecular structure

Identifiers & Physical Properties

CAS No.830319-99-8
Molecular formulaC14H14O5
Average molar mass262.26 g/mol
Monoisotopic mass262.08412354 g/mol
SMILESCOc1cccc(OC)c1O.O=C1C=CC(=O)C=C1
InChIKeyYXTCLTWHTWSDMK-UHFFFAOYSA-N
PubChem CID71416632
DTXSIDDTXSID00836008

Chemical & Physical Properties

Topological polar surface area72.8
Hydrogen bond donors1
Hydrogen bond acceptors5
Rotatable bonds2
Heavy atoms19
Formal charge0
Complexity253