Tianjin Hankang Pharmaceutical Biotechnology | [1-(Ethylsulfonyl)Azetidin-3-Ylidene]Acetonitrile | Related Intermediates | Manufacturers & Suppliers

[1-(Ethylsulfonyl)Azetidin-3-Ylidene]Acetonitrile

Chemistry, 2 End Use API, 15 Related Intermediates

Manufacturers/Suppliers

2 Suppliers

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Also known as: 1187595-85-2, 2-[1-(ethanesulfonyl)azetidin-3-ylidene]acetonitrile, [1-(ethylsulfonyl)azetidin-3-ylidene]acetonitrile, 2-[1-(ethylsulfonyl)-3-azetidinylidene]acetonitrile, 2-(1-ethylsulfonylazetidin-3-ylidene)acetonitrile, Schembl871344

Molecular Formula

C₇H₁₀N₂O₂S

Molecular Weight

186.23 g/mol

InChI Key

HQUIOHSYUKWGOM-UHFFFAOYSA-N

1 2D Structure

[1-(Ethylsulfonyl)Azetidin-3-Ylidene]Acetonitrile

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(1-ethylsulfonylazetidin-3-ylidene)acetonitrile

2.1.2 InChI

InChI=1S/C7H10N2O2S/c1-2-12(10,11)9-5-7(6-9)3-4-8/h3H,2,5-6H2,1H3

2.1.3 InChI Key

HQUIOHSYUKWGOM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCS(=O)(=O)N1CC(=CC#N)C1

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1187595-85-2

2. 2-[1-(ethanesulfonyl)azetidin-3-ylidene]acetonitrile

3. [1-(ethylsulfonyl)azetidin-3-ylidene]acetonitrile

4. 2-[1-(ethylsulfonyl)-3-azetidinylidene]acetonitrile

5. 2-(1-ethylsulfonylazetidin-3-ylidene)acetonitrile

6. Schembl871344

7. Amy4434

8. Dtxsid801221980

9. Bcp13973

10. Cs-m2446

11. Mfcd22987586

12. Akos025146561

13. Zinc114741608

14. Ds-8954

15. Sb52163

16. Ac-30033

17. Da-31808

18. Ft-0744137

19. P13428

20. (1-ethanesulfonyl-azetidin-3-ylidene)-acetonitrile

21. A892929

2.3 Create Date

2012-08-19

3 Chemical and Physical Properties

Molecular Formula	C₇H₁₀N₂O₂S
Molecular Weight	186.23 g/mol
XLogP3	-0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	186.04629874 g/mol
Monoisotopic Mass	186.04629874 g/mol
Topological Polar Surface Area	69.6 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	333
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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CAS Number

1224944-77-7

End Use API

Baricitinib

About the Company

Established in 1999, Hankang Pharmaceutical Group stands as a prominent CRO-CDMO integrated service enter...

Established in 1999, Hankang Pharmaceutical Group stands as a prominent CRO-CDMO integrated service enterprise in China. Focused on generic drugs while venturing into innovative ones, the group is dedicated to offering comprehensive solutions to the industry. Presently, Hankang has crafted over 200 varieties for 600+ domestic and international companies, serving 10+ innovative drugs. It has successfully developed more than 10 initial generic drugs, with over 20 varieties endorsed by the top three domestic companies and 30 exceeding a 100 million output value.