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4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine - 95%, high purity , CAS No.1261365-81-4
Discover 4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine by Aladdin Scientific in 95% for only $1,426.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine | 1261365-81-4 | DTXSID401223722 | MFCD18374095 | AKOS015853645 | CS-0081665 | D74373 | Pyridine, 4-iodo-2,3-dimethoxy-5-(trifluoromethyl)- | 4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine, AldrichCPR
Specifications & Purity
≥95%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
O-alkylpyrimidines
Alternative Parents
Polyhalopyridines Methylpyridines Alkyl aryl ethers 2-halopyridines Heteroaromatic compounds Vinyl iodides Propargyl-type 1,3-dipolar organic compounds Iodoalkenes Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-alkylpyrimidine - Polyhalopyridine - 2-halopyridine - Methylpyridine - Alkyl aryl ether - Pyridine - Heteroaromatic compound - Azacycle - Iodoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl iodide - Vinyl halide - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-alkylpyrimidines. These are compounds containing a pyrimidine , which is O-alkylated at one or more ring positions.
External Descriptors
Not available
Data sources
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.
Names and Identifiers
IUPAC Name
4-iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine
INCHI
InChI=1S/C8H7F3INO2/c1-14-6-5(12)4(8(9,10)11)3-13-7(6)15-2/h3H,1-2H3
InChIKey
ZFISGSRXCHTAGD-UHFFFAOYSA-N
Smiles
COC1=C(C(=CN=C1OC)C(F)(F)F)I
Isomeric SMILES
COC1=C(C(=CN=C1OC)C(F)(F)F)I
PubChem CID
50989276
Molecular Weight
333
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
333.050 g/mol
XLogP3
2.700
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
2
Exact Mass
332.947 Da
Monoisotopic Mass
332.947 Da
Topological Polar Surface Area
31.400 Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
215.000
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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