Valsynthese

CAS 42518-98-9

Chemistry, 9 End Use API, 85 Related Intermediates

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2 Intermediates

2 Intermediates

Also known as: 42518-98-9, 5-chorothiophene-2-carbonyl chloride, 5-chlorothiophene-2-carbonylchloride, 5-chloro-2-thenoyl chloride, 5-chloro-2-thiophenecarbonyl chloride, 5-chloro-thiophene-2-carbonyl chloride

Molecular Formula

C₅H₂Cl₂OS

Molecular Weight

181.04 g/mol

InChI Key

BMPDCQVRKDNUAP-UHFFFAOYSA-N

FDA UNII

V8Z66S2CJ3

1 2D Structure

CAS 42518-98-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-chlorothiophene-2-carbonyl chloride

2.1.2 InChI

InChI=1S/C5H2Cl2OS/c6-4-2-1-3(9-4)5(7)8/h1-2H

2.1.3 InChI Key

BMPDCQVRKDNUAP-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=C(SC(=C1)Cl)C(=O)Cl

2.2 Other Identifiers

2.2.1 UNII

V8Z66S2CJ3

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 42518-98-9

2. 5-chorothiophene-2-carbonyl Chloride

3. 5-chlorothiophene-2-carbonylchloride

4. 5-chloro-2-thenoyl Chloride

5. 5-chloro-2-thiophenecarbonyl Chloride

6. 5-chloro-thiophene-2-carbonyl Chloride

7. 2-thiophenecarbonyl Chloride, 5-chloro-

8. V8z66s2cj3

9. Unii-v8z66s2cj3

10. Schembl76028

11. 5-chlorothiophenecarbonyl Chloride

12. Dtxsid00343348

13. 5-chlorothiophene Carbonyl Chloride

14. Albb-011190

15. Bcp11850

16. Cs-d0711

17. Zinc2168777

18. 5-chloro-thiophen-carboxylic Chloride

19. Bbl014852

20. Mfcd00043886

21. Stl197261

22. Akos005173302

23. 5-chloro Thiophene-2-carbonyl Chloride

24. Ab01959

25. 5-chloranylthiophene-2-carbonyl Chloride

26. 5-chloro-2-thiophenecarbonyl Chloride #

27. 5-chlorothiophenecarboxylic Acid Chloride

28. Ac-23924

29. As-18729

30. Db-002596

31. 5-chloro-2-thiophenecarboxylic Acid Chloride

32. 5-chloro-thiophen-2-carboxylic Acid-chloride

33. 5-chlorothiophene-2-carboxylic Acid Chloride

34. Am20090749

35. Bb 0262879

36. Ft-0639797

37. 5-chloro-thiophene-2-carboxylic Acid Chloride

38. 5-chloro-thiophene-2-carboxylic Acid-chloride

39. A825922

40. Q-102522

41. F2146-0390

2.4 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₅H₂Cl₂OS
Molecular Weight	181.04 g/mol
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	179.9203412 g/mol
Monoisotopic Mass	179.9203412 g/mol
Topological Polar Surface Area	45.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	128
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

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Switzerland

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4-4-Aminophenyl-3-Morpholinone

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CAS Number

438056-69-0

End Use API

Rivaroxaban

About the Company

Valsynthese, a privately held CDMO, is a member of the SSE Group. Headquartered in Brig, Switzerland, it ...

Valsynthese, a privately held CDMO, is a member of the SSE Group. Headquartered in Brig, Switzerland, it has a broad international reach. With over a century of experience in highly hazardous and energetic chemistry, it has the expertise to develop fine chemical projects and has established the capability to produce key chemical intermediates and APIs under GMP and ISO certification. Valsynthese is regarded as one of Europe's most experienced CDMO chemical producers. It offers a variety of projects, ranging from lab procedures to tonne-scale manufacturing. It supplies its customers with high-quality products at competitive prices.