(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate | CAS No. 136310-64-0

(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate

Basic Information

CAS Number

136310-64-0

Molecular Formula

C18H19NO4S2

Molecular Weight

377.49 g/mol

AD

Basic Physical Properties

Melting Point

138-140°C

Boiling Point

542.3°C at 760 mmHg

CN1C2CC(CC1C3C2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O

InChI

InChI=1S/C18H19NO4S2/c1-19-11-8-10(9-12(19)16-15(11)23-16)22-17(20)18(21,13-4-2-6-24-13)14-5-3-7-25-14/h2-7,10-12,15-16,21H,8-9H2,1H3/t10-,11-,12+,15-,16+

InChIKey

VPJFFOQGKSJBAY-FDAWXEHDSA-N

LogP

2.2011

Topological Polar Surface Area

62.3 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

527

Safety Information

View Safety Information

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
H332 Harmful if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • Scopine di(2-thienyl)glycolate
  • N-Demethyl Tiotropium
  • rel-(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2-hydroxy-2,2-di(thiophen-2-yl)acetate
  • DS-13309
  • (1R,2R,4S,5S,7R)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0,nonan-7-yl 2-hydroxy-2,2-bis(thiophen-2-yl)acetate
  • CS-0187628
  • VPJFFOQGKSJBAY-UGTXJPTRSA-N
  • 2-Thiopheneacetic acid, alpha-hydroxy-alpha-2-thienyl-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, (1alpha,2beta,4beta,5alpha,7beta)-
  • (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2-Hydroxy-2,2-dithiophen-2-ylacetate
  • (1alpha,2beta,4beta,5alpha,7beta)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl alpha-hydroxy-alpha-2-thienyl-2-thiopheneacetate
  • Scopine Di(2-thienyl) Glycolate
  • [(1R,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2,2-dithiophen-2-ylacetate
  • DTXSID601110074
  • (1R,2R,4S,5S,7s)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2-hydroxy-2,2-di(thiophen-2-yl)acetate
  • 2-Thiopheneacetic acid, alpha-hydroxy-alpha-2-thienyl-, (1alpha,2beta,4beta,5alpha,7beta)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester
  • SCHEMBL9889327
  • Scopine-2,2-dithienyl glycolate
  • Di(2-thienyl)glycolic acid scopine ester
  • Not available;Scopine di(2-thienyl)glycolate
  • AKOS015920475
  • (1alpha,2beta,4beta,5alpha,7beta)-7-[(Hydroxydi(2-thienyl)acetyl)oxy]-9-methyl-3-oxa-9-azatricyclo[3.3.1.0]nonane
  • Scopine hydroxydi(2-thienyl)acetate
  • Scopine Di(2-thienylglycolate)
  • Dithienylglycolic acid scopine ester
  • 89HVZ5E8SB
  • Scopinedi(2-thienyl)glycolate
  • MFCD09038796
  • 136310-64-0
  • Scopine di-(2-thienyl)glycolate
  • A849914
  • (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2,2-Di(2-thienyl)glycolate

MDL Number

MFCD09038796

FAQ

What regulatory guidelines apply to (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate (CAS: 136310-64-0)?

This compound is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) for hazardous substances. Specific requirements include classification for reactivity, health, and environmental hazards. Under the European Union's REACH regulations, this compound may require registration and assessment. Additionally, it is important to comply with FDA and EPA guidelines for handling, storage, and disposal to ensure safety and environmental protection.

Are there alternatives to (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate (CAS: 136310-64-0) in synthesis?

While (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate is a specific compound, alternatives such as other azatricyclic or thienyl-acetate derivatives can be used depending on the desired properties. Common alternative reagents include various thioacetates and aziridines, but the choice depends on the synthetic route and desired product characteristics.

What is the market or research trend for (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate (CAS: 136310-64-0)?

Research on this compound is ongoing, with a focus on its applications in areas such as pharmaceuticals and materials science. Recent trends include exploring its use in drug discovery for specific targets and in developing novel materials. Market interest is driven by its unique chemical structure, making it a valuable compound for specialized research and applications.

How should waste containing (1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl hydroxy(di-2-thienyl)acetate (CAS: 136310-64-0) be handled?

Waste containing this compound should be collected in appropriate containers and stored in a dry, cool, and well-ventilated area. For disposal, it is recommended to use professional waste disposal services to ensure compliance with local regulations. Incineration or chemical neutralization may be necessary to reduce the environmental impact, and all handling procedures should follow safety guidelines to prevent exposure and environmental contamination.

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...