Bhushilpa Chemicals

CAS 5409-58-5

Chemistry, 1 End Use API, 5 Related Intermediates

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Also known as: 5409-58-5, (3-dimethylamino)-1''-propionapthone hydrochloride, 3-(dimethylamino)-1-naphthalen-1-ylpropan-1-one;hydrochloride, 3-(dimethylamino)-1-(1-naphthyl)-1-propanone hydrochloride, Mfcd00554996, 3-(dimethylamino)-1-(1-naphthalenyl)-1-propanone hydrochloride

Molecular Formula

C₁₅H₁₈ClNO

Molecular Weight

263.76 g/mol

InChI Key

GUTDWEKYWTXJGD-UHFFFAOYSA-N

1 2D Structure

CAS 5409-58-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-(dimethylamino)-1-naphthalen-1-ylpropan-1-one;hydrochloride

2.1.2 InChI

InChI=1S/C15H17NO.ClH/c1-16(2)11-10-15(17)14-9-5-7-12-6-3-4-8-13(12)14;/h3-9H,10-11H2,1-2H3;1H

2.1.3 InChI Key

GUTDWEKYWTXJGD-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN(C)CCC(=O)C1=CC=CC2=CC=CC=C21.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 5409-58-5

2. (3-dimethylamino)-1''-propionapthone Hydrochloride

3. 3-(dimethylamino)-1-naphthalen-1-ylpropan-1-one;hydrochloride

4. 3-(dimethylamino)-1-(1-naphthyl)-1-propanone Hydrochloride

5. Mfcd00554996

6. 3-(dimethylamino)-1-(1-naphthalenyl)-1-propanone Hydrochloride

7. 3-dimethylamino-1-(naphthalen-1-yl)propan-1-one Hydrochloride

8. 1-propanone, 3-(dimethylamino)-1-(1-naphthalenyl)-, Hydrochloride

9. 3-(dimethylamino)-1-(naphthalen-1-yl)propan-1-one Hcl

10. 1-propanone,3-(dimethylamino)-1-(1-naphthalenyl)-, Hydrochloride (1:1)

11. 3-(dimethylamino)-1-naphthalen-1-ylpropan-1-one,hydrochloride

12. Schembl297233

13. Amy447

14. Dtxsid30636457

15. Bcp10258

16. Cs-b0837

17. Nsc12491

18. Nsc 12491

19. Nsc-12491

20. Akos022182609

21. Ac-28387

22. As-19594

23. Da-23676

24. Sy027707

25. Ft-0714136

26. A852340

27. 3-(dimethylamino)-1-(1-naphthyl)-1-propanone Hcl

28. (3-dimethylamino)-1-propionapthone Hydrochloride

29. 3-dimethylamino-1-naphthalen-1-ylpropan-1-one Hydrochloride

30. 3-(dimethylamino)-1-(naphthalen-1-yl)propan-1-onehydrochloride

31. 3-(dimethylamino)-1-(naphthalen-1-yl)propan-1-one--hydrogen Chloride (1/1)

2.3 Create Date

2008-02-29

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₈ClNO
Molecular Weight	263.76 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	263.1076919 g/mol
Monoisotopic Mass	263.1076919 g/mol
Topological Polar Surface Area	20.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	262
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	2

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3-PHENYL PROPIONYL CHLORIDE

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CAS Number

645-45-4

End Use API

Bedaquiline

About the Company

Bhushilpa Chemicals was set up in 2001 with a vision to develop, manufacture and market specialty chemic...

Bhushilpa Chemicals was set up in 2001 with a vision to develop, manufacture and market specialty chemicals and drug intermediates through implementation of quality, regulatory, environmental and safety norms. Located in MIDC Kurkumbh, a dedicated pharmaceutical and chemical hub centre on the Pune Sholapur Highway (India), the unit is well equipped with plant and machinery and laboratory facilities to cater for the growing demand in the chemical industry.

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