(1S)-Cyclohex-3-Ene-1-Carboxylic Acid

Chemistry, 1 End Use API, 48 Related Intermediates

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Also known as: 5708-19-0, (1s)-cyclohex-3-ene-1-carboxylic acid, (s)-cyclohex-3-enecarboxylic acid, (s)-3-cyclohexene-1-carboxylic acid, (s)-(+)-3-cyclohexenecarboxylic acid, 3-cyclohexene-1-carboxylic acid, (1s)-

Molecular Formula

C₇H₁₀O₂

Molecular Weight

126.15 g/mol

InChI Key

VUSWCWPCANWBFG-ZCFIWIBFSA-N

1 2D Structure

(1S)-Cyclohex-3-Ene-1-Carboxylic Acid

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(1S)-cyclohex-3-ene-1-carboxylic acid

2.1.2 InChI

InChI=1S/C7H10O2/c8-7(9)6-4-2-1-3-5-6/h1-2,6H,3-5H2,(H,8,9)/t6-/m1/s1

2.1.3 InChI Key

VUSWCWPCANWBFG-ZCFIWIBFSA-N

2.1.4 Canonical SMILES

C1CC(CC=C1)C(=O)O

2.1.5 Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 5708-19-0

2. (1s)-cyclohex-3-ene-1-carboxylic Acid

3. (s)-cyclohex-3-enecarboxylic Acid

4. (s)-3-cyclohexene-1-carboxylic Acid

5. (s)-(+)-3-cyclohexenecarboxylic Acid

6. 3-cyclohexene-1-carboxylic Acid, (1s)-

7. (s)-(-)-3-cyclohexene-1-carboxylic Acid

8. Mfcd08275437

9. (s)-cyclohex-3-enecarboxylicacid

10. (s)-(-)-cyclohex-3-enecarboxylic Acid

11. Schembl468425

12. Act03213

13. Zinc4202671

14. (s)-(-)-3-cyclohexenecarboxylicacid

15. Akos006287439

16. S)-(-)-3-cyclohexenecarboxylic Acid

17. (1s)-3-cyclohexene-1-carboxylic Acid

18. Am10071

19. Cs-w018428

20. Ac-33550

21. As-34197

22. Ft-0774177

23. 708n190

24. (s)-(-)-1,2,3,6-tetrahydrobenzoic Acid

25. (1s)-cyclohex-3-ene-1-carboxylic Acid; (s)-(+)-3-cyclohexenecarboxylic Acid

26. (s)-(-)-3-cyclohexenecarboxylic Acid; (s)-cyclohex-3-enecarboxylic Acid

2.3 Create Date

2006-07-29

3 Chemical and Physical Properties

Molecular Formula	C₇H₁₀O₂
Molecular Weight	126.15 g/mol
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	126.068079557 g/mol
Monoisotopic Mass	126.068079557 g/mol
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	138
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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(s)-(-)-3-cyclohexenecarboxylic acid

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CAS Number

5708-19-0

End Use API

Edoxaban Tosylate

About the Company

Founded in 2003, Senary Chem is one of the Key High-Tech Enterprises of National Torch Plan. Senary locat...

Founded in 2003, Senary Chem is one of the Key High-Tech Enterprises of National Torch Plan. Senary located in National Cangzhou Lingang Economic and Technological Development Zone,Cangzhou City,Hebei Province. Senary cover an area of 67,000 square meters, and 300 professionals work there. Senary R&D organization recognized as the Hebei Provincial Engineering Technology Center is comprised of two R & D centers in Tianjin and Cangzhou, and it employs 80 experienced scientists in total. Senary focus on the development, production and sales of advanced pharmaceutical intermediates. Especially, Senary has leading technology and manufacturing capacity for diabetes drug intermediates. All intermediates of DPP4 and SGLT2 class drugs on market have been commercialized production. Senary has 150 sets of 50 ~ 8000L reactor with annual production capacity of 1,000 tons, which can handle both low and high temperature reactions within -100 ~ 240 ℃ range, all kinds of catalytic reactions within 0 ~ 5MPa pressure, and moisture and/or oxygen sensitive reactions. Senary also has expertise in chiral synthesis with leading technologies. The advanced sewage treatment system at Senery has processing capacity of 600 tons daily. Senary has an excellent team that has rich quality management experience.We have established a set of normative and perfect quality managment system,monitoring the whole process of risk assessment,R&D,transfer from pilot scale to commercial production,manufacturing,analysis and sales service. Senary will continue to dedicate on the field of pharmaceutical intermediates to provide the best service for domestic and foreign API pharmaceutical companies with high quality and timely supply of products.

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