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CAS 1335210-23-5 manufacturers and suppliers on PharmaCompass

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CAS 1335210-23-5
Also known as: 1335210-23-5, Dolutegravir intermediate-1, 1-(2,2-dimethoxyethyl)-5-methoxy-6-methoxycarbonyl-4-oxopyridine-3-carboxylic acid, Mfcd28978322, 1-(2,2-dimethoxyethyl)-1,4-dihydro-3-methoxy-4-oxo-2,5-pyridinedicarboxylic acid 2-methyl ester, Schembl2415069
Molecular Formula
C13H17NO8
Molecular Weight
315.28  g/mol
InChI Key
XAXGEECGULRZGN-UHFFFAOYSA-N

1 2D Structure

CAS 1335210-23-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(2,2-dimethoxyethyl)-5-methoxy-6-methoxycarbonyl-4-oxopyridine-3-carboxylic acid
2.1.2 InChI
InChI=1S/C13H17NO8/c1-19-8(20-2)6-14-5-7(12(16)17)10(15)11(21-3)9(14)13(18)22-4/h5,8H,6H2,1-4H3,(H,16,17)
2.1.3 InChI Key
XAXGEECGULRZGN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=C(N(C=C(C1=O)C(=O)O)CC(OC)OC)C(=O)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1335210-23-5

2. Dolutegravir Intermediate-1

3. 1-(2,2-dimethoxyethyl)-5-methoxy-6-methoxycarbonyl-4-oxopyridine-3-carboxylic Acid

4. Mfcd28978322

5. 1-(2,2-dimethoxyethyl)-1,4-dihydro-3-methoxy-4-oxo-2,5-pyridinedicarboxylic Acid 2-methyl Ester

6. Schembl2415069

7. Amy4343

8. Bcp15319

9. Akos027339716

10. Zinc118844009

11. 1-[2,2-bis(methyloxy)ethyl]-5-(methyloxy)-6-[(methyloxy)carbonyl]-4-oxo-1,4-dihydro-3-pyridinecarboxylic Acid

12. Ac-30660

13. Ds-12376

14. Sy103843

15. Db-121226

16. Hy-100083

17. Cs-0018060

18. F11564

19. A854814

20. 1-(2,2-dimethoxyethyl)-1,4-dihydro-3-methoxy-4-oxo-2,5-pyridinedicarboxylic Acid 2-methyl Este

21. 1-(2,2-dimethoxyethyl)-5-methoxy-6-(methoxycarbonyl)-4-oxo-1,4-dihydropyridine-3-carboxylicacid

2.3 Create Date
2011-10-31
3 Chemical and Physical Properties
Molecular Weight 315.28 g/mol
Molecular Formula C13H17NO8
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass315.09541650 g/mol
Monoisotopic Mass315.09541650 g/mol
Topological Polar Surface Area112 Ų
Heavy Atom Count22
Formal Charge0
Complexity532
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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1335210-23-5
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Jinan Tantu Chemicals Co., Ltd. operates as a Contract Development and Manufacturing Organization (CDMO) ...
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Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manuf...
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Nantong Chem-land Co., Ltd. is located in Nantong city, a developed port city which distance from Shangha...
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Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic Uni...
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OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company...
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