9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one

Basic Information

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CAS Number

549-21-3

Molecular Formula

C20H17NO5

Molecular Weight

351.36 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Orange powder

Melting Point

200-201 ºC

Solubility

Insuluble (1.8E-3 g/L) (25 ºC),

SMILES

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COC1=C(C2=C(C=C1)C=C3C4=CC5=C(C=C4CCN3C2=O)OCO5)OC

InChI

InChI=1S/C20H17NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9H,5-6,10H2,1-2H3

InChIKey

ZHYQCBCBTQWPLC-UHFFFAOYSA-N

LogP

2.9705000000000013

Topological Polar Surface Area

58.92 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

607

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

8-Oxoberberine
Oxyberberin
Oxyberberine (Berlambine)
Berlambine; 8-Oxoberberine; Ketoberberine
BCP23559
AKOS037514568
BDBM50508730
8-BERBINONE, 13,13a-DIDEHYDRO-9,10-DIMETHOXY-2,3-(METHYLENEDIOXY)-
FT-0701411
BERBERIN-8-ONE
CHEMBL11531
549-21-3
8H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizin-8-one, 5,6-dihydro-9,10-dimethoxy-
16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaen-14-one
HY-N5027
Berbin-8-one, 13,13a-didehydro-9,10-dimethoxy-2,3-(methylenedioxy)-
NSC93138
8H-BENZO(G)-1,3-BENZODIOXOLO(5,6-A)QUINOLIZIN-8-ONE, 5,6-DIHYDRO-9,10-DIMETHOXY-
ZHYQCBCBTQWPLC-UHFFFAOYSA-N
CS-0032110
JKL-1073A
8-Oxyberberine
NSC 93138
NSC-93138
MS-25426
DTXSID70203389
AC-35010
9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-8-one #
4A04YKB3FT
Oxyberberine
9,10-Dimethoxy-2,3-(methylenedioxy)-13,13a-didehydro-8-berbinone

MDL Number

MFCD00189453

FAQ

What regulatory guidelines apply to 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3)?

The compound 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) falls under various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA requirements for chemical handling and safety. Compliance with these guidelines is crucial for safe transport, storage, and use.

Are there alternatives to 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) in synthesis?

While 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) is a specific compound, alternatives such as 9,10-dimethoxyisoquinoline and other similar isoquinoline derivatives can be used in synthesis. These alternatives may offer similar or enhanced properties, but their selection should be based on the specific requirements of the reaction and application.

What is the market or research trend for 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3)?

The research trend for 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) is focused on its potential applications in pharmaceuticals, agrochemicals, and functional materials. The compound's unique structure and properties are driving interest in further exploration, particularly in drug discovery and development.

How should waste containing 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) be handled?

Waste containing 9,10-Dimethoxy-5,6-dihydro-8H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-8-one (CAS: 549-21-3) should be collected and disposed of in accordance with local regulations. Safe disposal methods include incineration, professional waste disposal services, and ensuring environmental protection measures are in place to prevent contamination. Proper documentation and adherence to environmental safety protocols are essential.