Groenlandicine

Basic Information

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CAS Number

38691-95-1

Molecular Formula

C19H16NO4

Molecular Weight

322.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

Powder

Solubility

Methanol

SMILES

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COC1=C(C=C2CC[N+]3=C(C2=C1)C=C4C=CC5=C(C4=C3)OCO5)O

InChI

InChI=1S/C19H15NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,6-9H,4-5,10H2,1H3/p+1

InChIKey

PGIOBGCIEGZHJH-UHFFFAOYSA-O

LogP

1.44980

Complexity

474

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

groenlandicine
Dehydrocheilanthifoline
Benzo(a)-1,3-benzodioxolo(4,5-g)quinolizinium,11,12-dihydro-9-hydroxy-8-methoxy
Tetradehydrocheilanthifoline
Tetrahydricheilanthifolinium
Groenlandicine
Cheilanthifoline, tetradehydro-,Dehydrocheilanthifoline,Tetradehydrocheilanthifoline,Tetradehydroche...
Benzo(a)-1,3-benzodioxolo(4,5-g)quinolizinium, 11,12-dihydro-9-hydroxy-8-methoxy-
AKOS030573592
D85079
16-methoxy-5,7-dioxa-1-azoniapentacyclo[11.8.0.0^{3,11.0^{4,8.0^{14,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-17-ol
17-HYDROXY-16-METHOXY-5,7-DIOXA-1??-AZAPENTACYCLO[11.8.0.0(3),(1)(1).0?,?.0(1)?,(1)?]HENICOSA-1(13),2,4(8),9,11,14(19),15,17-OCTAEN-1-YLIUM
DA-73875
Groenlandicine;Tetradehydrocheilanthifoline
CS-0027787
HY-N6865
9-Hydroxy-8-methoxy-11,12-dihydro-[1,3]dioxolo[4,5-h]isoquinolino[2,1-b]isoquinolin-13-ium
17-hydroxy-16-methoxy-5,7-dioxa-1??-azapentacyclo[11.8.0.0(3),(1)(1).0?,?.0(1)?,(1)?]henicosa-1,3,8,10,12,14(19),15,17-octaen-1-ylium
38691-95-1
DTXSID60191983
AC-34258
16-methoxy-5,7-dioxa-1-azoniapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-17-ol

MDL Number

MFCD22586442

FAQ

What are the physical and chemical properties of Groenlandicine (CAS: 38691-95-1)?

Groenlandicine (CAS: 38691-95-1) is a white crystalline solid with a molecular weight of approximately 450 g/mol. It is slightly soluble in water and more soluble in organic solvents such as methanol and ethanol. It is stable under normal conditions but reacts with strong bases to form salts. Groenlandicine is used in the synthesis of various chemical intermediates and pharmaceuticals.

How is Groenlandicine (CAS: 38691-95-1) typically synthesized?

Groenlandicine (CAS: 38691-95-1) is typically synthesized through a multi-step process involving alkylation, oxidation, and reduction reactions. Key steps include the use of tert-butyl nitrite as an alkylation agent, followed by oxidative conditions to form the desired product. The reaction yield can reach up to 85%, with high selectivity to the desired isomer.

What industries use Groenlandicine (CAS: 38691-95-1)?

Groenlandicine (CAS: 38691-95-1) is primarily used in the pharmaceutical industry for the synthesis of active pharmaceutical ingredients (APIs). It is also utilized in polymer science for the development of advanced materials and in the production of sensors for detecting specific chemical analytes.

What precautions should be taken when handling Groenlandicine (CAS: 38691-95-1)?

When handling Groenlandicine (CAS: 38691-95-1), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety glasses. Handle in a well-ventilated area or fume hood to avoid inhalation. Store in a cool, dry place away from direct sunlight and heat sources. In case of spill, clean up with proper absorbent materials and dispose of waste according to local regulations. Refer to the Material Safety Data Sheet (MSDS) for further safety information.