Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate | CAS No. 23964-58-1

Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate

Basic Information

CAS Number

23964-58-1

Molecular Formula

C13H20N2O3S

Molecular Weight

284.38 g/mol

AD

Basic Physical Properties

Boiling Point

bp0.3 162-167°

Density

1.178

Flash Point

220.3 ºC

Refractive Index

1.556

CCCNC(C)C(=O)NC1=C(SC=C1C)C(=O)OC

InChI

InChI=1S/C13H20N2O3S/c1-5-6-14-9(3)12(16)15-10-8(2)7-19-11(10)13(17)18-4/h7,9,14H,5-6H2,1-4H3,(H,15,16)

InChIKey

QTGIAADRBBLJGA-UHFFFAOYSA-N

LogP

2.16972

Topological Polar Surface Area

67.43 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

325

Synonyms & References

English

  • AB00514635
  • Artemtherin
  • DTXSID7048536
  • D07468
  • AKOS005287449
  • METHYL 4-METHYL-3-(2-(PROPYLAMINO)PROPIONAMIDO)-2-THIOPHENECARBOXYLATE
  • DB09009
  • ARTICAINEHYDROCHLORIDE
  • 2-Thiophenecarboxylic acid, 4-methyl-3-((1-oxo-2-(propylamino)propyl)amino)-, methyl ester
  • HOE-45
  • ARTICAINE [INN]
  • Articaine
  • BPBio1_001368
  • Methyl (4-methyl-3-(2-(propylamino)propionamido)-2-thiophencarboxylat)
  • AC-27016
  • HY-B0516A
  • Q-200652
  • methyl 4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylate
  • D3SQ406G9X
  • CS-0009469
  • Methyl 4-methyl-3-([2-(propylamino)propanoyl]amino)-2-thiophenecarboxylate #
  • ARTICAINE [WHO-DD]
  • VS-07343
  • Articainum [INN-Latin]
  • Articaina
  • 23964-58-1
  • Prestwick3_001032
  • Q421297
  • QTGIAADRBBLJGA-UHFFFAOYSA-N
  • Prestwick1_001032
  • F88299

MDL Number

MFCD00864454

FAQ

What are the physical and chemical properties of Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1)?

Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1) is a crystalline compound with a molecular weight of approximately 319.4 g/mol. It has a low solubility in water but is soluble in common organic solvents like ethanol and acetone. This compound is stable under normal temperature and pressure conditions, but it can react with strong bases and acids. It is moderately reactive towards nucleophiles.

How is Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1) typically synthesized?

Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1) is synthesized via a multi-step process involving the reaction of 4-methyl-3-aminothiophenecarboxylic acid with N-propylalanine in the presence of a suitable coupling agent, such as HATU, and a base like DIPEA. The reaction typically yields 75-85% pure product after purification.

What industries use Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1)?

Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1) is used in the pharmaceutical industry for the synthesis of certain bioactive molecules. It may also have applications in the polymer industry for modifying the properties of polymers, and in the sensor industry for the development of chemical sensors.

What precautions should be taken when handling Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1)?

When handling Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate (CAS: 23964-58-1), it is important to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be stored in a cool, dry place away from strong acids and bases. In case of a spill, it should be cleaned up using appropriate safety measures, and the incident should be reported to the safety officer. Always consult the Safety Data Sheet (SDS) for detailed handling instructions.

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