(7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one

Basic Information

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CAS Number

522-17-8

Molecular Formula

C23H22O6

Molecular Weight

394.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

85-87 °C

Boiling Point

560.1℃/760mmHg

Solubility

DMSO: >10 mg/mL

Specific Rotation

D27 -97.2° (c = 0.2 in benzene)

SMILES

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CC1(C=CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC)C

InChI

InChI=1S/C23H22O6/c1-23(2)8-7-12-15(29-23)6-5-13-21(24)20-14-9-17(25-3)18(26-4)10-16(14)27-11-19(20)28-22(12)13/h5-10,19-20H,11H2,1-4H3/t19-,20+/m1/s1

InChIKey

ORDAZKGHSNRHTD-UXHICEINSA-N

LogP

4.007900000000003

Topological Polar Surface Area

63.22000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

674

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

SPBio_000236
CS-1802
NCGC00025288-03
KBio2_004092
Spectrum4_001965
SPECTRUM201138
Deguelin
DTXSID10200231
Tocris-1770
AC-35505
AKOS024456769
BCP9000596
HY-13425
Spectrum_001044
DEGUELIN(-)
(-)-Deguelin
3H-Bis(1)benzopyrano(3,4-b:6',5'-e)pyran-7(7aH)-one, 13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-, (7aS,13aS)-
Spectrum3_001122
Q5251862
CHEBI:4357
(7as,13as)-13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-3h-bis[1]benzopyrano[3,4-b:6',5'-e]pyran-7(7ah)-one
BRD-K61401890-001-02-0
MFCD01740600
AS-56004
MLS006010295
KBio2_006660
BDBM50505204
Spectrum2_000298
HMS3268E12
CCG-39856
CHEMBL393417

MDL Number

MFCD01740600

FAQ

What regulatory guidelines apply to (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8)?

The compound (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which requires hazard communication including labels and safety data sheets. In Europe, it is also subject to the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulation. The FDA and EPA have specific guidelines for handling and disposal to ensure environmental safety and human health protection.

Are there alternatives to (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) in synthesis?

There are several alternatives to (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) in synthesis, including isomers such as (7aR,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one and its analogs. Common alternative reagents include 7,10-dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one and other related compounds.

What is the market or research trend for (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8)?

The market for (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) is primarily driven by its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its potential as an intermediate in drug synthesis and as an active ingredient in pesticides. The increasing demand in these sectors is expected to drive market growth in the coming years.

How should waste containing (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) be handled?

Waste containing (7aS,13aS)-9,10-Dimethoxy-3,3-dimethyl-13,13a-dihydro-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (CAS: 522-17-8) should be collected and stored in appropriate containers to prevent environmental contamination. Incineration is a common method for disposal, but it should be performed in a controlled manner to comply with local regulations. For professional waste disposal, companies specializing in hazardous waste management should be utilized to ensure safe handling and disposal, adhering to all environmental protection measures.