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4-Chloro-2-methoxypyridine-3-carbaldehyde - 98%, high purity , CAS No.1008451-58-8
Discover 4-Chloro-2-methoxypyridine-3-carbaldehyde by Aladdin Scientific in 98% for only $1,855.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
1008451-58-8 | 4-Chloro-2-methoxynicotinaldehyde | 4-chloro-2-methoxypyridine-3-carbaldehyde | 4-CHLORO-2-METHOXY-PYRIDINE-3-CARBALDEHYDE | MFCD13188720 | 3-PYRIDINECARBOXALDEHYDE, 4-CHLORO-2-METHOXY- | SCHEMBL438652 | AMY8068 | DTXSID90696118 | FURZPPOFSODEOQ-UHFFFAOYSA-N
Specifications & Purity
≥98%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridine carboxaldehydes
Intermediate Tree Nodes
Not available
Direct Parent
Pyridine carboxaldehydes
Alternative Parents
Aryl-aldehydes Alkyl aryl ethers Aryl chlorides Vinylogous halides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-pyridine carboxaldehyde - Alkyl aryl ether - Aryl-aldehyde - Aryl chloride - Aryl halide - Heteroaromatic compound - Vinylogous halide - Ether - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aldehyde - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridine carboxaldehydes. These are aromatic compounds containing a pyridine ring which bears a carboxaldehyde group.
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-chloro-2-methoxypyridine-3-carbaldehyde
INCHI
InChI=1S/C7H6ClNO2/c1-11-7-5(4-10)6(8)2-3-9-7/h2-4H,1H3
InChIKey
FURZPPOFSODEOQ-UHFFFAOYSA-N
Smiles
COC1=NC=CC(=C1C=O)Cl
Isomeric SMILES
COC1=NC=CC(=C1C=O)Cl
Molecular Weight
171.6
Reaxy-Rn
19606331
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19606331&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
171.580 g/mol
XLogP3
1.200
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
171.009 Da
Monoisotopic Mass
171.009 Da
Topological Polar Surface Area
39.200 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
142.000
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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