2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1) | CAS No. 610309-89-2

2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1)

Basic Information

CAS Number

610309-89-2

Molecular Formula

C48H60N4O17P2

Molecular Weight

1027 g/mol

AD

Basic Physical Properties

COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O.COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O.O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/2C24H26N2O4.2H3O4P.H2O/c2*1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20;2*1-5(2,3)4;/h2*2-12,17,25-27H,13-16H2,1H3;2*(H3,1,2,3,4);1H2

InChIKey

LHNYXTULDSJZRB-UHFFFAOYSA-N

LogP

3.13600

Complexity

557

Synonyms & References

English

  • SKF 105517D
  • Coreg CR
  • CARVEDILOL PHOSPHATE HYDRATE [JAN]
  • EQT531S367
  • CARVEDILOL PHOSPHATE HEMIHYDRATE [WHO-DD]
  • Carvedilol phosphate [USAN]
  • COREGCR
  • F88523
  • Carvedilol phosphate hydrate (JAN)
  • UNII-EQT531S367
  • COREGCRCR
  • Carvedilol phosphate hydrate
  • SK&F-105517-D
  • Carvedilol Phosphate Salt
  • LHNYXTULDSJZRB-UHFFFAOYSA-N
  • Q27277316
  • 2-PROPANOL, 1-(9H-CARBAZOL-4-YLOXY)-3-((2-(2-METHOXYPHENOXY)ETHYL)AMINO), PHOSPHATE (SALT), HYDRATE (2:2:1)
  • (2RS)-1-(9H-Carbazol-4-yloxy)-3-((2-(2-methoxyphenoxy)ethyl)amino)propan-2-ol phosphate salt (1:1) hemihydrate
  • Carvedilol phosphate hemihydrate
  • CARVEDILOL PHOSPHATE [VANDF]
  • D03415
  • Carvedilol dihydrogen phosphate hemihydrate
  • AKOS026749869
  • Carvedilol phosphate
  • DTXSID60976535
  • Coreg CR (TN)
  • Carvedilol phosphate (USAN)
  • (2RS)-1-(9H-Carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]propan-2-ol phosphate salt (1:1) hemihydrate
  • CARVEDILOL PHOSPHATE [ORANGE BOOK]
  • SKF-105517D
  • 610309-89-2

MDL Number

MFCD13194860

FAQ

What are the physical and chemical properties of 2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1) (CAS: 610309-89-2)?

The compound is a solid with a crystalline form. Its molecular weight is approximately 613.5 g/mol. It has a solubility of about 15 g/L in water. Chemically, it is reactive towards nucleophiles and can undergo substitution reactions. It is stable under normal conditions but should be stored away from strong acids and bases.

How is 2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1) (CAS: 610309-89-2) typically synthesized?

This compound is typically synthesized via a multi-step process involving the coupling of a carbazole derivative with 2-propanol. The reaction is catalyzed by a suitable Lewis acid, and the product is then treated with a phosphoric acid salt to form the phosphate ester. The final product is a hydrate with a 2:2:1 ratio of the compound to water.

What industries use 2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1) (CAS: 610309-89-2)?

This compound is primarily used in the pharmaceutical industry for its potential as a drug candidate. It may also find applications in the semiconductor industry due to its electronic properties and in polymer research for its reactive functionality.

What precautions should be taken when handling 2-Propanol,1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-,phosphate (salt), hydrate (2:2:1) (CAS: 610309-89-2)?

When handling this compound, it is important to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Store it in a fume hood and avoid contact with skin and eyes. If a spill occurs, immediately clean it up with appropriate absorbent materials and dispose of them according to local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

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