Methyl 6-hydroxy-5-iodonicotinate

Name: Methyl 6-hydroxy-5-iodonicotinate
Brand: ChemScene
Availability: InStock
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CAS No. 885950-46-9
Cat. No. CS-0081055
Purity≥95%
MDL No.MFCD08276965

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Methyl 6-hydroxy-5-iodonicotinate|CS-0081055

Structure of 885950-46-9

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General Information

CAS No. 885950-46-9
Cat. No. CS-0081055
Purity ≥95%
MDL No. MFCD08276965
Storage 4°C, protect from light, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆INO₃
Molecular Weight 279.03
Synonym(s) 5-Iodo-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid Methyl ester
SMILES OC1=C(I)C=C(C(OC)=O)C=N1

Synthesis

Route1
- In-stock
  
  66171-50-4
- ~82%
- In-stock
  
  885950-46-9
References
- Dott, Pascal; Waldmeier, Pius Patent: US2012/101282 A1, 2012 ; Location in patent: Page/Page column 6 ;
Route2
- 5006-66-6
- ~%
- In-stock
  
  885950-46-9
References
- Wishka, Donn G.; Walker, Daniel P.; Yates, Karen M.; Reitz, Steven C.; Jia, Shaojuan; Myers, Jason K.; Olson, Kirk L.; Jacobsen, E. Jon; Wolfe, Mark L.; Groppi, Vincent E.; Hanchar, Alexander J.; Thornburgh, Bruce A.; Cortes-Burgos, Luz A.; Wong, Erik H. F.; Staton, Brian A.; Raub, Thomas J.; Higdon, Nicole R.; Wall, Theron M.; Hurst, Raymond S.; Walters, Rodney R.; Hoffmann, William E.; Hajos, Mihaly; Franklin, Stanley; Carey, Galen; Gold, Lisa H.; Cook, Karen K.; Sands, Steven B.; Zhao, Sabrina X.; Soglia, John R.; Kalgutkar, Amit S.; Arneric, Stephen P.; Rogers, Bruce N. Journal of Medicinal Chemistry, 2006 , vol. 49, # 14 p. 4425 - 4436

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 59.42
LogP 1.1784
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Iodide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 6-hydroxy-5-iodonicotinate

CAS No. 885950-46-9

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