CAS 104618-32-8

Chemistry, 2 End Use API, 6 Related Intermediates

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Also known as: 104618-32-8, 2-(4-oxocyclohexyl)isoindoline-1,3-dione, 4-(phthalimido)-cyclohexanone, N-(4-oxocyclohexyl)phthalimide, 2-(4-oxo-cyclohexyl)-isoindole-1,3-dione, 2-(4-oxocyclohexyl)isoindole-1,3-dione

Molecular Formula

C₁₄H₁₃NO₃

Molecular Weight

243.26 g/mol

InChI Key

PWUJQPNLEZZILN-UHFFFAOYSA-N

1 2D Structure

CAS 104618-32-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(4-oxocyclohexyl)isoindole-1,3-dione

2.1.2 InChI

InChI=1S/C14H13NO3/c16-10-7-5-9(6-8-10)15-13(17)11-3-1-2-4-12(11)14(15)18/h1-4,9H,5-8H2

2.1.3 InChI Key

PWUJQPNLEZZILN-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CC(=O)CCC1N2C(=O)C3=CC=CC=C3C2=O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 104618-32-8

2. 2-(4-oxocyclohexyl)isoindoline-1,3-dione

3. 4-(phthalimido)-cyclohexanone

4. N-(4-oxocyclohexyl)phthalimide

5. 2-(4-oxo-cyclohexyl)-isoindole-1,3-dione

6. 2-(4-oxocyclohexyl)isoindole-1,3-dione

7. N-(4-oxocyclohexyl) Phthalimide

8. Mfcd00158659

9. 1h-isoindole-1,3(2h)-dione, 2-(4-oxocyclohexyl)-

10. 2-(4-oxocyclohexyl)-1h-isoindole-1,3(2h)-dione

11. 4-phthalimido Cyclohexanone

12. Schembl633891

13. 2-(4-oxocyclohexyl)-2,3-dihydro-1h-isoindole-1,3-dione

14. Dtxsid10475523

15. Amy14785

16. L-proline,1-(2-propenyl)-(9ci)

17. Zinc22008408

18. Akos000369805

19. Ac-3543

20. Sb30365

21. As-19965

22. Sy053034

23. Cs-0116979

24. Ft-0753192

25. O0365

26. O10482

27. 2-(4-oxocyclohexyl)-1h-isoindole-1,3(2h)dione

28. Z1744688031

2.3 Create Date

2007-02-05

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₃NO₃
Molecular Weight	243.26 g/mol
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	243.08954328 g/mol
Monoisotopic Mass	243.08954328 g/mol
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	370
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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Acharya Chemicals

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4-(Phthalimido) Cyclohexanone

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CAS Number

104618-32-8

End Use API

Pramipexole Dihydrochloride

About the Company

Established in 1975, Acharya Group is a trusted and well-established chemical manufacturing company renow...

Established in 1975, Acharya Group is a trusted and well-established chemical manufacturing company renowned for its commitment to technological excellence. Acharya’s core operations include the production, contract research and custom manufacturing of APIs, intermediates and specialty chemicals. With an annual turnover of ₹125 crores, where more than 90% is generated through global exports, Acharya Group has a proven track record of serving the European and US markets. Equipped with five independent manufacturing facilities, Acharya possesses extensive expertise in handling production across various scales, from laboratory to plant.

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Kores India Limited

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4-Phthalimidocyclohexanone

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CAS Number

104618-32-8

End Use API

Pramipexole Dihydrochloride

About the Company

The division was established in 1981 as a Specialty Chemicals Division with a focus to manufacture specia...

The division was established in 1981 as a Specialty Chemicals Division with a focus to manufacture specialty chemicals and pharmaceutical intermediates. In April 2006, the division has been renamed as ‘Pharmaceuticals & Chemicals Division’ to focus strongly on the manufacturing of active pharmaceutical ingredients and pharmaceutical intermediates. Located at Roha, the manufacturing site is about 140 km from the city of Mumbai and occupies an area of 40,000 sq.m. The division employs over 200 people and has the capacity to develop and execute a range of chemical processes. It also provides for innovative process design and scale-up.

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