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Aldehydes and ketones

Chrysoqueen

Also known as (3aS,4R,11bS)-4,5a,6,10,11a-pentahydroxy-8-methoxy-4-methyl-3a,5,6,11b-tetrahydroanthra[1,2-d][1,3]dioxole-2,11-dione, (3aS,4R,11bS)-4,5a,6,10,11a-pentahydroxy-8-methoxy-4-methyl-3a,5,6,11b-tetrahydroanthra(1,2-d)(1,3)dioxole-2,11-dione

CAS 521964-21-6Formula C17H18O10Molar mass 382.32 g/mol
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Chrysoqueen chemical structure, C17H18O10, CAS 521964-21-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
521964-21-6
Formula
C17H18O10
Molar mass
382.32 g/mol
HS code
292090
Category
Aldehydes and ketones

What is Chrysoqueen?

Plain description, key identifiers and synonyms

Chrysoqueen is a member of tetralins.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(3aS,4R,11bS)-4,5a,6,10,11a-pentahydroxy-8-methoxy-4-methyl-3a,5,6,11b-tetrahydroanthra[1,2-d][1,3]dioxole-2,11-dione
CAS number
521964-21-6
Molecular formula
C17H18O10
InChIKey
HAECORBRWKQWGT-MDOOKUCQSA-N
InChI
InChI=1S/C17H18O10/c1-15(22)5-16(23)10(19)7-3-6(25-2)4-8(18)9(7)11(20)17(16,24)13-12(15)26-14(21)27-13/h3-4,10,12-13,18-19,22-24H,5H2,1-2H3/t10?,12-,13-,15+,16?,17?/m0/s1
Canonical SMILES
COc1cc(O)c2c(c1)C(O)C1(O)CC(C)(O)C3OC(=O)OC3C1(O)C2=O
Isomeric SMILES
C[C@]1(CC2(C(C3=C(C(=CC(=C3)OC)O)C(=O)C2([C@@H]4[C@@H]1OC(=O)O4)O)O)O)O

Synonyms

  • (3aS,4R,11bS)-4,5a,6,10,11a-pentahydroxy-8-methoxy-4-methyl-3a,5,6,11b-tetrahydroanthra[1,2-d][1,3]dioxole-2,11-dione
  • (3aS,4R,11bS)-4,5a,6,10,11a-pentahydroxy-8-methoxy-4-methyl-3a,5,6,11b-tetrahydroanthra(1,2-d)(1,3)dioxole-2,11-dione

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
382.32 g/molcalc.
Exact mass
382.09 Dacalc.
LogP (octanol/water)
-0.85calc.
Topological polar surface area
163 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
10calc.
Rotatable bonds
1calc.
Heavy atoms
27calc.
Rings
4calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.53calc.
Formal charge
0calc.
Stereocentres
6calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1OC2CCC3Cc4ccccc4C(=O)C3C2O1

O=C1OC2CCC3Cc4ccccc4C(=O)C3C2O1

4 rings, 19 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Chrysoqueen suppliers

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Chrysoqueen price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Chrysoqueen is traded under.

HS 2920.90Indicative HS code

Esters, other than thiophosphoric esters (phosphorothioates) and phosphite esters and their salts…

World exports in 2024
$1.05B
+8.0% vs 2023, imports $1.23B
2019 to 2024
Top exporters
  1. China33.4%
  2. Germany18.8%
  3. United States12.4%
Top importers
  1. United States19.2%
  2. Singapore8.9%
  3. South Korea6.9%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Chrysoqueen is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Chrysoqueen, based on the data on this page

What is Chrysoqueen?

Chrysoqueen is a member of tetralins.

What is the CAS number of Chrysoqueen?

The CAS registry number of Chrysoqueen is 521964-21-6.

What is the molecular formula and weight of Chrysoqueen?

The molecular formula of Chrysoqueen is C17H18O10 and its molar mass is 382.32 g/mol.

Is Chrysoqueen hazardous?

No GHS hazard classification for Chrysoqueen is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Chrysoqueen?

Chrysoqueen is usually classified under HS code 292090 (Esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Chrysoqueen?

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What is the price of Chrysoqueen?

Suppliers quote Chrysoqueen on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Chrysoqueen

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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