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1,8-Bis(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)anthra-9,10-quinone

HCID 362909
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Basic information

CAS
111959-51-4
Standard SMILES
COCCOCCOCCOc1cccc2c1C(=O)c1c(OCCOCCOCCOC)cccc1C2=O
InChIKey
IHRYASVSVCTIBK-UHFFFAOYSA-N
Molecular formula
C28H36O10
Average molar mass
532.6 g/mol
Monoisotopic mass
532.23084734

Names & identifiers

Preferred name
1,8-Bis(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)anthra-9,10-quinone
IUPAC
1,8-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]anthracene-9,10-dione

Names & synonyms

NSC627384111959-51-41,8-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]anthracene-9,10-dione1,8-Bis{2-[2-(2-methoxyethoxy)ethoxy]ethoxy}anthracene-9,10-dione1,8-Bis(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)anthra-9,10-quinoneDTXSID10327033NSC-627384

Database identifiers

CAS
111959-51-4
PubChem CID
362909
DTXSID
DTXSID10327033

Properties

Computed structural propertiesFilling in

XLogP
1.9
Topological polar surface area
108 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
20
Heavy atoms
38
Formal charge
0
Complexity
622

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Compound notes

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