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4-Iodo-5-methoxynicotinonitrile - 98%, high purity , CAS No.1138444-07-1

COA

Grade & Purity:

≥98%

Cas Number: 1138444-07-1
Molecular Weight: 260.03
PubChem CID: 46736773

In stock

Item Number

I166040

Grouped product items
SKU	Size	Availability	Price
I166040-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$51.90
I166040-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$196.90
I166040-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$605.90

Discover 4-Iodo-5-methoxynicotinonitrile by Aladdin Scientific in 98% for only $51.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	BS-26153 \| 4-iodo-5-methoxypyridine-3-carbonitrile \| MFCD11857678 \| 4-Iodo-5-methoxynicotinonitrile, AldrichCPR \| 4-Iodo-5-methoxynicotinonitrile \| FT-0724395 \| D74402 \| AKOS015853945 \| DTXSID10673860 \| 1138444-07-1 \| EN300-4267029
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass 3-pyridinecarbonitriles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	3-pyridinecarbonitriles
Intermediate Tree Nodes	Not available
Direct Parent	3-pyridinecarbonitriles
Alternative Parents	Alkyl aryl ethers Aryl iodides Heteroaromatic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organoiodides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	3-pyridinecarbonitrile - Alkyl aryl ether - Aryl halide - Aryl iodide - Heteroaromatic compound - Ether - Carbonitrile - Nitrile - Azacycle - Organoiodide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile 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

IUPAC Name	4-iodo-5-methoxypyridine-3-carbonitrile
INCHI	InChI=1S/C7H5IN2O/c1-11-6-4-10-3-5(2-9)7(6)8/h3-4H,1H3
InChIKey	JQINMVXYGGFTBP-UHFFFAOYSA-N
Smiles	COC1=C(C(=CN=C1)C#N)I
Isomeric SMILES	COC1=C(C(=CN=C1)C#N)I
WGK Germany	3
PubChem CID	46736773
Molecular Weight	260.03

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	260.029 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	259.945 Da
Monoisotopic Mass	259.945 Da
Topological Polar Surface Area	45.900 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	177.000
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

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