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CAS 916982-10-0
Also known as: 916982-10-0, 4-isobutylpiperidine-2,6-dione, 2,6-piperidinedione, 4-(2-methylpropyl)-, 3-isobutylglutarimid, 4-(2-methylpropyl)piperidine-2,6-dione (3-isobutylglutarimide), 4-isobutyl-piperidine-2,6-dione
Molecular Formula
C9H15NO2
Molecular Weight
169.22  g/mol
InChI Key
FNAQPQLVCOZGRH-UHFFFAOYSA-N

1 2D Structure

CAS 916982-10-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-(2-methylpropyl)piperidine-2,6-dione
2.1.2 InChI
InChI=1S/C9H15NO2/c1-6(2)3-7-4-8(11)10-9(12)5-7/h6-7H,3-5H2,1-2H3,(H,10,11,12)
2.1.3 InChI Key
FNAQPQLVCOZGRH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)CC1CC(=O)NC(=O)C1
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 916982-10-0

2. 4-isobutylpiperidine-2,6-dione

3. 2,6-piperidinedione, 4-(2-methylpropyl)-

4. 3-isobutylglutarimid

5. 4-(2-methylpropyl)piperidine-2,6-dione (3-isobutylglutarimide)

6. 4-isobutyl-piperidine-2,6-dione

7. 3-isobutylglutarimide

8. Pregabalin Impurity 9

9. 3-isobutyl Glutarimide

10. Schembl2019434

11. Mfcd18277013

12. Zinc34804554

13. Akos012458062

14. Sb41085

15. As-18964

16. Db-088524

17. E79247

18. A917355

19. Z1695922826

2.3 Create Date
2007-03-07
3 Chemical and Physical Properties
Molecular Weight 169.22 g/mol
Molecular Formula C9H15NO2
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass169.110278721 g/mol
Monoisotopic Mass169.110278721 g/mol
Topological Polar Surface Area46.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity183
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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With over twenty years of experience in chemicals and pharmaceuticals industries, our team boasts unparalleled expertise in fine chemicals, advanced pharmaceutical intermediates, and various process industries. Renowned for our reputation, we provide top-tier solutions to outsourcing needs through our own product manufacturing and CDMO services. Our facility holds a level 4 country approval (US, Canada, United Kingdom, European Union, Japan, Switzerland, Australia, Cuba, Brazil, & Mexico), featuring a multi-purpose plant with a capacity exceeding 350KL (API and in-house KSM), with the potential for doubling capacity within the same premises.
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Pregabalin
With over twenty years of experience in chemicals and pharmaceuticals industries, our team boasts unparal...
With over twenty years of experience in chemicals and pharmaceuticals industries, our team boasts unparalleled expertise in fine chemicals, advanced pharmaceutical intermediates, and various process industries. Renowned for our reputation, we provide top-tier solutions to outsourcing needs through our own product manufacturing and CDMO services. Our facility holds a level 4 country approval (US, Canada, United Kingdom, European Union, Japan, Switzerland, Australia, Cuba, Brazil, & Mexico), featuring a multi-purpose plant with a capacity exceeding 350KL (API and in-house KSM), with the potential for doubling capacity within the same premises.
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