Rr Lifesciences

CAS 116817-84-6

Chemistry, 1 End Use API, 26 Related Intermediates

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Also known as: 116817-84-6, Duloxetine impurity 18, Rac-alpha-[2-(dimethylamino)ethyl]-3-thiophenemethanol, 3-(dimethylamino)-1-thiophen-3-ylpropan-1-ol, (s)-3-(dimethylamino)-1-(thiophen-3-yl)propan-1-ol, Schembl3461

Molecular Formula

C₉H₁₅NOS

Molecular Weight

185.29 g/mol

InChI Key

HKVIPLMMUMBSKB-UHFFFAOYSA-N

1 2D Structure

CAS 116817-84-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-(dimethylamino)-1-thiophen-3-ylpropan-1-ol

2.1.2 InChI

InChI=1S/C9H15NOS/c1-10(2)5-3-9(11)8-4-6-12-7-8/h4,6-7,9,11H,3,5H2,1-2H3

2.1.3 InChI Key

HKVIPLMMUMBSKB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN(C)CCC(C1=CSC=C1)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 116817-84-6

2. Duloxetine Impurity 18

3. Rac-alpha-[2-(dimethylamino)ethyl]-3-thiophenemethanol

4. 3-(dimethylamino)-1-thiophen-3-ylpropan-1-ol

5. (s)-3-(dimethylamino)-1-(thiophen-3-yl)propan-1-ol

6. Schembl3461

7. Dtxsid701248385

8. Akos006291528

9. Sb47713

10. Cs-0441433

11. 3-thiophenemethanol, A-[2-(dimethylamino)ethyl]

12. 817t846

13. Alpha-[2-(dimethylamino)ethyl]-3-thiophenemethanol

14. S-(-)-n,n-dimethyl-3-hydroxy-3-(2-thienyl)-1-propylamide

2.3 Create Date

2007-02-09

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₅NOS
Molecular Weight	185.29 g/mol
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	51.7
Heavy Atom Count	12
Formal Charge	0
Complexity	130
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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3-Dimethylamino-1-(2-thienyl)-1-propanol hydrochloride

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CAS Number

13636-02-7

End Use API

Duloxetine

About the Company

RR LIFESCIENCES manufactures products purely by organic synthesis to offer its customers a choice of prod...

RR LIFESCIENCES manufactures products purely by organic synthesis to offer its customers a choice of products in their areas. Our facilities are equipped with a range of reactor sizes, glass lined reactors and S.S. Reactors, some reactors are capable of operating at high extreme temperature. Other equipments includes Centrifuges, Vacuum Tray Drier, Multi Mills, Tray Drier, in clean finishing suites. All Our facilities are GMP complaint, designed to maintain the highest standards of safety. Our R&D scale-up capabilities from lab scale to commercialization. Our team of experts interacts with our customers from the initial stages of the project to ensure successful completion of the project. We follow stringent quality assurance norms and it has the domain expertise and state of art of facilities to develop analytical methods for evaluating quality of raw materials, intermediates and final products. Our R&D scale-up capabilities from lab scale to commercialization. Our team of experts interacts with our customers from the initial stages of the project to ensure successful completion of the project. We follow stringent quality assurance norms and it has the domain expertise and state of art of facilities to develop analytical methods for evaluating quality of raw materials, intermediates and final products.

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