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Also known as: Methyl 3-oxopentanoate, 30414-53-0, Methyl propionylacetate, Pentanoic acid, 3-oxo-, methyl ester, 3-oxo-pentanoic acid methyl ester, Mfcd00011705
Molecular Formula
C6H10O3
Molecular Weight
130.14  g/mol
InChI Key
XJMIXEAZMCTAGH-UHFFFAOYSA-N
FDA UNII
Y9CQ6VT8U5

CAS 30414-53-0
1 2D Structure

CAS 30414-53-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 3-oxopentanoate
2.1.2 InChI
InChI=1S/C6H10O3/c1-3-5(7)4-6(8)9-2/h3-4H2,1-2H3
2.1.3 InChI Key
XJMIXEAZMCTAGH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCC(=O)CC(=O)OC
2.2 Other Identifiers
2.2.1 UNII
Y9CQ6VT8U5
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Methyl 3-oxopentanoate

2. 30414-53-0

3. Methyl Propionylacetate

4. Pentanoic Acid, 3-oxo-, Methyl Ester

5. 3-oxo-pentanoic Acid Methyl Ester

6. Mfcd00011705

7. 3-oxovaleric Acid Methyl Ester

8. Methyl 3-oxo-n-valerate

9. Valeric Acid, 3-oxo-, Methyl Ester

10. Methyl .beta.-ketovalerate

11. Y9cq6vt8u5

12. 3-oxopentanoic Acid Methyl Ester

13. 3-keto-n-valeric Acid Methyl Ester

14. Methyl 3-oxo-pentanoate

15. Methyl3-oxovalerate

16. Einecs 250-184-3

17. Methyl-3-oxovalerate

18. Methyl 3-ketovalerate

19. Methyl 3-oxo-valerate

20. Methyl-3-oxopentanoate

21. Methyl 3-ketopentanoate

22. Methyl-3-ketopentanoate

23. Methyl-3-oxo-pentanoate

24. 3-oxo-methyl Pentanoate

25. 3-oxopentansauremethylester

26. Unii-y9cq6vt8u5

27. Ec 250-184-3

28. Schembl4604

29. 3-oxovaleric Acid Methylester

30. 3-ketovaleric Acid Methyl Ester

31. Xjmixeazmctagh-uhfffaoysa-

32. Dtxsid40184499

33. Propionylacetic Acid Methyl Ester

34. 3-oxopentanoic Acid, Methyl Ester

35. Zinc391839

36. Act03020

37. Amy21932

38. Ac7866

39. Stl185597

40. Akos000120601

41. Cs-w011110

42. Gs-3030

43. Sy007180

44. Db-017471

45. Ft-0615941

46. K0035

47. A820360

48. W-106944

49. F0001-0934

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 130.14 g/mol
Molecular Formula C6H10O3
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass130.062994177 g/mol
Monoisotopic Mass130.062994177 g/mol
Topological Polar Surface Area43.4 Ų
Heavy Atom Count9
Formal Charge0
Complexity118
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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SUPPLIERS

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01

Suanfarma

Spain
  • fda
  • EDQM
  • WHO-GMP

Virtual BoothSuanFarma is present in all origins: Natural, Chemical & Biotechnological.

Methyl 3-Oxopentanoate

CAS Number : 30414-53-0

End Use API :

About the Company : Suanfarma founded in 1993, is a B2B life science partner committed to health & innovation by developing, manufacturing, & distributing high-quality APIs for the pharmaceutical industry ...

Suanfarma

02

ASC 2024
Not Confirmed
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Ethyl-R-(+)chloro-3-hydroxybutyrate

CAS Number : 90866-33-4

End Use API :

About the Company : Established in 2016, a state-of-the-art R&D facility engaged in the development of Novel processes for Bulk Actives including Deuterated Actives, Advanced Intermediates and up the value...

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03

ASC 2024
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Methyl-3-oxopentanoate

CAS Number : 30414-53-0

End Use API :

About the Company : Established in 2016, a state-of-the-art R&D facility engaged in the development of Novel processes for Bulk Actives including Deuterated Actives, Advanced Intermediates and up the value...

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04

ASC 2024
Not Confirmed
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ASC 2024
Not Confirmed

Methyl Propionic Acetate

CAS Number : 30414-53-0

End Use API :

About the Company : Litmus Organics Pvt. Ltd., established in 2005, aims to be a leading chemical manufacturer in India. Equipped with the latest technology and testing facilities, our dedicated and skille...

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05

ASC 2024
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METHYL 3-OXOPENTANOATE

CAS Number : 30414-53-0

End Use API :

About the Company : SAINTSUN PHARMA, we are engaging mainly in the manufacturing and distributing APIs, Pharmaceutical Intermediates, Chemicals, Formulations, Medical supplies, etc... With a self-owned bra...

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06

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Methyl 3-oxopentanoate

CAS Number : 30414-53-0

End Use API :

About the Company : Zhejiang Apeloa Medical Technology Co., Ltd.(Zhejiang Apeloa Jiayuan Pharmaceutical Co., Ltd.) is a medicinal industry enterprise integrating R&D, manufacturing,marketing and contract...

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END USE APIs

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Polpharma

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Inke S.A

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DKSH

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Egis Pharmaceuticals PLC

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Jai Radhe Sales

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Polpharma

Polpharma is a Polish CDMO of APIs and a significant European API producer, delivering products to companies worldwide.

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LGM Pharma accelerates & optimizes the new product pathway from early development through commercialization.

Jai Radhe Sales

Jai Radhe Sales is your partner for all your sourcing needs.

Octavius Pharma Pvt. Ltd

Octavius has been empowering lives since 1980 by providing quality products like DC granules, APIs and FDFs.

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Shandong Boyuan is a Chinese manufacturer of GMP & CEP APIs & pharmaceutical intermediates.

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