Skip to the beginning of the images gallery

6-Isopropoxynicotinic acid - 96%, high purity , CAS No.223127-05-7

COA

Grade & Purity:

≥96%

Cas Number: 223127-05-7
Molecular Weight: 181.19
PubChem CID: 18625738
PubChem SID: 488199640

In stock

Item Number

I192144

Grouped product items
SKU	Size	Availability	Price
I192144-25mg	25mg	2	$10.90
I192144-100mg	100mg	2	$35.90
I192144-250mg	250mg	2	$67.90
I192144-500mg	500mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$121.90
I192144-1g	1g	1	$167.90

Basic Description

Synonyms	6-isopropoxynicotinic acid \| 223127-05-7 \| 6-propan-2-yloxypyridine-3-carboxylic acid \| 6-(propan-2-yloxy)pyridine-3-carboxylic acid \| 6-Isopropoxynicotnic acid \| MFCD09811743 \| 6-Isopropoxynicotinicacid \| 3-Pyridinecarboxylicacid, 6-(1-methylethoxy)- \| SCHEMBL841924 \| DTX
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Pyridinecarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinecarboxylic acids
Alternative Parents	Alkyl aryl ethers Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyridine carboxylic acid - Alkyl aryl ether - Heteroaromatic compound - Azacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488199640
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488199640
IUPAC Name	6-propan-2-yloxypyridine-3-carboxylic acid
INCHI	InChI=1S/C9H11NO3/c1-6(2)13-8-4-3-7(5-10-8)9(11)12/h3-6H,1-2H3,(H,11,12)
InChIKey	OOIMOWCIYNEWCF-UHFFFAOYSA-N
Smiles	CC(C)OC1=NC=C(C=C1)C(=O)O
Isomeric SMILES	CC(C)OC1=NC=C(C=C1)C(=O)O
Molecular Weight	181.19
Reaxy-Rn	14124285
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14124285&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
K2129080	Certificate of Analysis	Sep 13, 2024	I192144
K2129081	Certificate of Analysis	Sep 13, 2024	I192144
K2130120	Certificate of Analysis	Sep 13, 2024	I192144
K2130121	Certificate of Analysis	Sep 13, 2024	I192144
K2130122	Certificate of Analysis	Sep 13, 2024	I192144

Chemical and Physical Properties

Molecular Weight	181.190 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	181.074 Da
Monoisotopic Mass	181.074 Da
Topological Polar Surface Area	59.400 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	182.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration