1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile | CAS No. 59729-33-8

1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile

Basic Information

CAS Number

59729-33-8

Molecular Formula

C20H21FN2O

Molecular Weight

324.39 g/mol

AD

Basic Physical Properties

Boiling Point

bp0.03 175-181°

CN(C)CCCC1(OCc2cc(C#N)ccc21)c3ccc(F)cc3

InChI

InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3

InChIKey

WSEQXVZVJXJVFP-UHFFFAOYSA-N

LogP

3.81298

Complexity

466

Safety Information

View Safety Information

Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

  • citalopram
  • CITALOPRAM INTERMEDIATES
  • 5-ISOBENZOFURANCARBONITRILE, 1,3-DIHYDRO-1-(3-(DIMETHYLAMINO)PROPYL)-1-(4-FLUOROPHENYL)-
  • 1-[3-(DIMETHYLAMINO)PROPYL]-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-5-ISOBENZOFURANCARBONITRILE
  • LU-10-171
  • CELEXA
  • (+/-)-CITALOPRAM
  • CITALOPRAM, HYDROBROMIDE SALT
  • NITALAPRAM
  • 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofuran-carbonitrile
  • 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile
  • 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
  • CITALOPRAM HYDROBROMIDE
  • Celapram
  • Cipram
  • Ciprapine
  • Citabax
  • Citalec
  • Citalopramum
  • Citopam
  • 1-3-(dimethylamino)propyl-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile

MDL Number

MFCD00865398

FAQ

What regulatory guidelines apply to 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8)?

Regulatory guidelines for 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) include GHS classification, REACH regulations, and FDA/EPA related requirements. It is important to check the most recent versions of these guidelines for compliance, as regulations can change and may differ between regions.

Are there alternatives to 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) in synthesis?

Several alternatives to 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) can be considered in synthesis, such as structurally similar compounds or using different functional groups. Common alternative reagents include fluorinated derivatives or analogs with similar pharmacological properties.

What is the market or research trend for 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8)?

The market for 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) is showing increasing research interest, particularly in its potential applications in medicinal chemistry and drug discovery. Recent trends indicate a growing focus on its synthesis and evaluation as a potential therapeutic agent.

How should waste containing 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) be handled?

Waste containing 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (CAS: 59729-33-8) should be managed according to local environmental regulations. Proper waste liquid collection, incineration, or professional waste disposal is recommended. Always ensure safety precautions are in place to protect the environment and human health during handling and disposal.

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