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[6-[2-(Trifluoromethoxy)phenyl]-3-pyridyl]methanol - ≥95%, high purity , CAS No.197847-95-3

COA

Grade & Purity:

≥95%

Cas Number: 197847-95-3
Molecular Weight: 269.22
PubChem CID: 24729918

In stock

Item Number

P731377

Grouped product items
SKU	Size	Availability	Price	Qty
P731377-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,260.90
P731377-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,617.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Phenylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Phenylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpyridines
Alternative Parents	Phenoxy compounds Phenol ethers Heteroaromatic compounds Trihalomethanes Azacyclic compounds Primary alcohols Organonitrogen compounds Organofluorides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2-phenylpyridine - Phenoxy compound - Phenol ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Trihalomethane - Azacycle - Alcohol - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Halomethane - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
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	[6-[2-(trifluoromethoxy)phenyl]pyridin-3-yl]methanol
INCHI	InChI=1S/C13H10F3NO2/c14-13(15,16)19-12-4-2-1-3-10(12)11-6-5-9(8-18)7-17-11/h1-7,18H,8H2
InChIKey	ASRVJOXNOCXQEA-UHFFFAOYSA-N
Smiles	C1=CC=C(C(=C1)C2=NC=C(C=C2)CO)OC(F)(F)F
Isomeric SMILES	C1=CC=C(C(=C1)C2=NC=C(C=C2)CO)OC(F)(F)F
PubChem CID	24729918
Molecular Weight	269.22

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	269.220 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	269.066 Da
Monoisotopic Mass	269.066 Da
Topological Polar Surface Area	42.400 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	286.000
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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[6-[2-(Trifluoromethoxy)phenyl]-3-pyridyl]methanol - ≥95%, high purity , CAS No.197847-95-3

Basic Description