CAS 4877-80-9 2,3,6,7,10,11-Hexahydroxytriphenylene, Hydrate

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2,3,6,7,10,11-Hexahydroxytriphenylene, Hydrate

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Catalog Number

ACM4877809-3

CAS Number

4877-80-9

Product Name

2,3,6,7,10,11-Hexahydroxytriphenylene, Hydrate

Structure

Category

Liquid Crystal (LC) Building Blocks

IUPAC Name

triphenylene-2,3,6,7,10,11-hexol

Molecular Weight

324.3g/mol

Molecular Formula

C18H12O6

Canonical SMILES

C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1O)O)O)O)O)O

InChI

InChI=1S/C18H12O6/c19-13-1-7-8(2-14(13)20)10-4-17(23)18(24)6-12(10)11-5-16(22)15(21)3-9(7)11/h1-6,19-24H

InChI Key

QMLILIIMKSKLES-UHFFFAOYSA-N

Complexity

364

Covalently-Bonded Unit Count

Exact Mass

324.063388g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

2,3,6,7,10,11-hexahydroxytriphenylene;HHTP cpd

Monoisotopic Mass

324.063388g/mol

Rotatable Bond Count

XLogP3

2.7

MSDS

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COA

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Spec Sheet

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