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Dimethyl(3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonate

Chemistry, 3 End Use API, 26 Related Intermediates

Manufacturers/Suppliers

3 Suppliers

3 Suppliers

Also known as: 61260-15-9, Dimethyl 3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonate, 3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid, 3-dimethoxyphosphoryl-3h-2-benzofuran-1-one, Mfcd16883476, 3-dimethoxyphosphoryl-3h-isobenzofuran-1-one

Molecular Formula

C₁₀H₁₁O₅P

Molecular Weight

242.16 g/mol

InChI Key

KEKUNQAVGWOYDW-UHFFFAOYSA-N

1 2D Structure

Dimethyl(3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-dimethoxyphosphoryl-3H-2-benzofuran-1-one

2.1.2 InChI

InChI=1S/C10H11O5P/c1-13-16(12,14-2)10-8-6-4-3-5-7(8)9(11)15-10/h3-6,10H,1-2H3

2.1.3 InChI Key

KEKUNQAVGWOYDW-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COP(=O)(C1C2=CC=CC=C2C(=O)O1)OC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 61260-15-9

2. Dimethyl 3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonate

3. 3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic Acid

4. 3-dimethoxyphosphoryl-3h-2-benzofuran-1-one

5. Mfcd16883476

6. 3-dimethoxyphosphoryl-3h-isobenzofuran-1-one

7. Schembl1689399

8. Dimethyl(3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonate

9. Dtxsid60455870

10. Amy38601

11. Cs-m0104

12. Akos016003673

13. Ac-29317

14. As-68381

15. Sy047475

16. Dimethyl 3-oxobenzo[c]furan-1-ylphosphonate

17. Ft-0699562

18. A857975

19. Dimethyl 3-oxo-1,3,-dihydroisobenzofuran-1-ylphosphonate

20. Dimethyl 3-oxo-1,3-dihydro-2-benzofuran-1-ylphosphonate

21. Dimethyl (3-oxo-1,3-dihydro-2-benzofuran-1-yl)phosphonate

22. (1,3-dihydro-3-oxoisobenzofuran-1-yl)phosphonic Acid Dimethyl Ester

23. (3-oxo-1,3-dihydro-isobenzofuran-1-yl) Phosphonic Acid Dimethyl Ester

24. (3-oxo-1,3-dihydro-isobenzofuran-1-yl)-phosphonic Acid Dimethyl Ester

25. (3-oxo-1,3-dihydro-isobenzofuran-1-yl)phosphonic Acid Dimethyl Ester

26. (3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonic Acid Dimethyl Ester

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₁O₅P
Molecular Weight	242.16 g/mol
XLogP3	0.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	242.03441044 g/mol
Monoisotopic Mass	242.03441044 g/mol
Topological Polar Surface Area	61.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	321
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

57260-71-6

End Use API

Olaparib

About the Company

SURVIVAL is one of the leading manufacturers in the field of Fine and Specialty Chemicals actively involv...

SURVIVAL is one of the leading manufacturers in the field of Fine and Specialty Chemicals actively involved in CRAMS, Custom Synthesis & Bulk Production offering new generation products in complex chemistry to Pharmaceutical, Agrochemical and Petrochemical companies. It has a very strong R&D set up & we can assure fast turn around in Synthsizing molecules. With our deep understanding of science and chemistry, we are into functional chemistry, custom synthesis and contract manufacturing catering to many reputed Indian and overseas customers.

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