Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1)

Basic Information

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CAS Number

242478-38-2

Molecular Formula

C27H32N2O6

Molecular Weight

480.56 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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

No data available

Melting Point

145.0 to 149.0 deg-C

Boiling Point

505.5°C at 760 mmHg

Flash Point

No data available

Vapor Pressure

No data available

SMILES

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C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C23H26N2O2.C4H6O4/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19;5-3(6)1-2-4(7)8/h1-9,18,21-22H,10-16H2;1-2H2,(H,5,6)(H,7,8)/t21-,22-;/m0./s1

InChIKey

RXZMMZZRUPYENV-VROPFNGYSA-N

LogP

3.8007000000000017

Topological Polar Surface Area

107.38000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 8

Complexity

617

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

CHEBI:32151
KKA5DLD701
242478-38-2
CS-0371
SW219141-1
Solifenacin Succinate Tablets
Solifenacin Succinate, United States Pharmacopeia (USP) Reference Standard
[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate;butanedioic acid
KS-1286
UNII-KKA5DLD701
EX-A4170
Vesicare (TN)
solifenacin succiate
SOLIFENACIN SUCCINATE [USP-RS]
(3R)-Quinuclidin-3-yl (1S)-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxylate succinate
(1S)-(3R)-1-azabicyclo[2.2.2]oct-3-yl-3,4-dihydro-1-phenyl-2(1H)-isoquinolinecarboxylate succinate
solifenacine succinate
AM84825
SOLIFENACIN SUCCINATE (EP MONOGRAPH)
YM-67905
HMS3887A13
SOLIFENACIN SUCCINATE [ORANGE BOOK]
solifenacin succinate10 mg
2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-1-phenyl-, (3R)-1-azabicyclo(2.2.2)oct-3-yl ester, (1S)-, butanedioate (1:1)
A881133
SOLIFENACIN SUCCINATE [MI]
Solifenacin succinate
MLS006010416
CCG-269551
MFCD00954234
AKOS015994745

MDL Number

MFCD09952287

FAQ

What is Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2)?

Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2) is a chemical compound formed by the esterification of succinic acid with a specific amine and isoquinoline derivative. It is a white to off-white solid with moderate solubility in organic solvents. This compound is known for its structural complexity and is often used in specialized chemical applications due to its unique functional groups and molecular framework.

What are the main uses of Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2)?

This compound is primarily used in pharmaceutical research for the development of drugs targeting specific metabolic pathways. It also finds applications in organic synthesis as a versatile intermediate. Additionally, it is used in the formulation of certain specialty chemicals and may be relevant in materials science for creating novel compounds with tailored properties.

Is Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2) safe?

Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2) is generally considered safe when handled properly. However, due to its chemical structure, it is advisable to take standard safety precautions, such as wearing gloves and safety goggles. It is important to follow guidelines for chemical exposure and storage to ensure safe handling in laboratory and industrial settings.

How should Succinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydrosuccinic acid - (3R)-1-azabicyclo[2.2.2]oct-3-yl (1S)-1-phenyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate (1:1) (CAS: 242478-38-2) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at 2-8°C. It is recommended to keep it in a sealed container to prevent moisture absorption and contamination. Avoid exposure to air and direct light to maintain its stability and prevent degradation. Proper storage ensures optimal performance and safety during handling and use.