CAS 69759-61-1

Chemistry, 2 End Use API, 2 Related Intermediates

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Also known as: 69759-61-1, 2-(dibutylamino)-1-(2,7-dichloro-9h-fluoren-4-yl)ethanol, 2,7-dichloro-alpha-[(dibutylamino)-methyl]-9h-fluorene-4-methanol, Schembl5808111, Chembl3230061, Dtxsid70330760

Molecular Formula

C₂₃H₂₉Cl₂NO

Molecular Weight

406.4 g/mol

InChI Key

DALUOHFKVYCDCW-UHFFFAOYSA-N

1 2D Structure

CAS 69759-61-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(dibutylamino)-1-(2,7-dichloro-9H-fluoren-4-yl)ethanol

2.1.2 InChI

InChI=1S/C23H29Cl2NO/c1-3-5-9-26(10-6-4-2)15-22(27)21-14-19(25)13-17-11-16-12-18(24)7-8-20(16)23(17)21/h7-8,12-14,22,27H,3-6,9-11,15H2,1-2H3

2.1.3 InChI Key

DALUOHFKVYCDCW-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCN(CCCC)CC(C1=CC(=CC2=C1C3=C(C2)C=C(C=C3)Cl)Cl)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 69759-61-1

2. 2-(dibutylamino)-1-(2,7-dichloro-9h-fluoren-4-yl)ethanol

3. 2,7-dichloro-alpha-[(dibutylamino)-methyl]-9h-fluorene-4-methanol

4. Schembl5808111

5. Chembl3230061

6. Dtxsid70330760

7. Mfcd12923306

8. Akos015899558

9. Sb66888

10. As-10058

11. Db-024460

12. A9224

13. Cs-0152113

14. Ft-0660547

15. D95749

16. 221d071

17. J-507537

18. 2-(di-n-butylamino)-1-[2,7-dichloro-9h-fluoren-4-yl]ethanol

19. 2-(dibutylamino)-1-(2,7-dichloro-9h-fluoren-4-yl)ethanol Hcl

20. 2-(dibutylamino)-1-(2,7-dichloro-9h-fluoren-4-yl)ethan-1-ol

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₂₃H₂₉Cl₂NO
Molecular Weight	406.4 g/mol
XLogP3	6.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Exact Mass	405.1626199 g/mol
Monoisotopic Mass	405.1626199 g/mol
Topological Polar Surface Area	23.5 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	440
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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CAS Number

32399-12-5

End Use API

Lumefantrine

About the Company

Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...

Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.

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