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CAS 881386-01-2 manufacturers and suppliers on PharmaCompass

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CAS 881386-01-2
Also known as: 881386-01-2, 3,3-dichloro-1-(4-nitrophenyl)-2-piperidinone, 2-piperidinone, 3,3-dichloro-1-(4-nitrophenyl)-, Schembl8253678, Dtxsid20729544, Amy40512
Molecular Formula
C11H10Cl2N2O3
Molecular Weight
289.11  g/mol
InChI Key
KKVYXBZVPRSWHE-UHFFFAOYSA-N

1 2D Structure

CAS 881386-01-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3,3-dichloro-1-(4-nitrophenyl)piperidin-2-one
2.1.2 InChI
InChI=1S/C11H10Cl2N2O3/c12-11(13)6-1-7-14(10(11)16)8-2-4-9(5-3-8)15(17)18/h2-5H,1,6-7H2
2.1.3 InChI Key
KKVYXBZVPRSWHE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(C(=O)N(C1)C2=CC=C(C=C2)[N+](=O)[O-])(Cl)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 881386-01-2

2. 3,3-dichloro-1-(4-nitrophenyl)-2-piperidinone

3. 2-piperidinone, 3,3-dichloro-1-(4-nitrophenyl)-

4. Schembl8253678

5. Dtxsid20729544

6. Amy40512

7. Bcp18031

8. Cs-m2357

9. Akos025401970

10. Zinc166869058

11. Ac-27670

12. Cs-13236

13. Da-24813

14. Ft-0730444

15. J-511063

2.3 Create Date
2012-08-19
3 Chemical and Physical Properties
Molecular Weight 289.11 g/mol
Molecular Formula C11H10Cl2N2O3
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass288.0068476 g/mol
Monoisotopic Mass288.0068476 g/mol
Topological Polar Surface Area66.1 Ų
Heavy Atom Count18
Formal Charge0
Complexity349
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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545445-44-1
Apixaban
CTX is one of the youngest and fastest-growing Indian API and Intermediate manufacturing companies doing ...
CTX is one of the youngest and fastest-growing Indian API and Intermediate manufacturing companies doing business in over 70 countries. In these five years, all my thoughts and actions have been to enhance the life of my organization by serving the pharmaceutical industry with complete dedication. CTX is accredited with US FDA, EU GMP, PMDA Japan and COFEPRIS Mexico cGMP. The ultimate business strategy of CTX Life Sciences is “ to be a partner in the global pharmaceutical and chemical industries and continue to be a reliable and consistent supplier of APIs and Intermediates.
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503614-91-3
Apixaban
CTX is one of the youngest and fastest-growing Indian API and Intermediate manufacturing companies doing ...
CTX is one of the youngest and fastest-growing Indian API and Intermediate manufacturing companies doing business in over 70 countries. In these five years, all my thoughts and actions have been to enhance the life of my organization by serving the pharmaceutical industry with complete dedication. CTX is accredited with US FDA, EU GMP, PMDA Japan and COFEPRIS Mexico cGMP. The ultimate business strategy of CTX Life Sciences is “ to be a partner in the global pharmaceutical and chemical industries and continue to be a reliable and consistent supplier of APIs and Intermediates.
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