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5-(Trifluoromethyl)pyridine-2-carbonyl chloride - 97%, high purity , CAS No.128073-05-2
Discover 5-(Trifluoromethyl)pyridine-2-carbonyl chloride by Aladdin Scientific in 97% for only $104.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
A889095 | STL554731 | 5-(Trifluoromethyl)pyridine-2-carbonyl chloride, 97% | SCHEMBL9779781 | MFCD11226644 | 5-Trifluoromethyl-pyridine-2-carbonyl chloride | BBL100937 | 2-Pyridinecarbonyl chloride, 5-(trifluoromethyl)- (9CI) | DTXSID40653377 | 5-(Trifluo
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids and derivatives
Alternative Parents
Heteroaromatic compounds Azacyclic compounds Acyl chlorides Organooxygen compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridine carboxylic acid or derivatives - Heteroaromatic compound - Acyl chloride - Acyl halide - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
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
5-(trifluoromethyl)pyridine-2-carbonyl chloride
INCHI
InChI=1S/C7H3ClF3NO/c8-6(13)5-2-1-4(3-12-5)7(9,10)11/h1-3H
InChIKey
XGGHEBGOZWCTKF-UHFFFAOYSA-N
Smiles
C1=CC(=NC=C1C(F)(F)F)C(=O)Cl
Isomeric SMILES
C1=CC(=NC=C1C(F)(F)F)C(=O)Cl
WGK Germany
3
PubChem CID
37859655
Molecular Weight
209.55
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°F)
>230 °F
Flash Point(°C)
>110 °C
Molecular Weight
209.550 g/mol
XLogP3
2.600
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
1
Exact Mass
208.986 Da
Monoisotopic Mass
208.986 Da
Topological Polar Surface Area
30.000 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
206.000
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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