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2-Hydroxy-3-nitro-5-(trifluoromethyl)pyridine - 98%, high purity , CAS No.33252-64-1

COA

Grade & Purity:

≥98%

Cas Number: 33252-64-1
Molecular Weight: 208.1
PubChem CID: 2775093
PubChem SID: 504761892

In stock

Item Number

N183778

Grouped product items
SKU	Size	Availability	Price
N183778-1g	1g	2	$141.90
N183778-5g	5g	2	$543.90
N183778-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$978.90
N183778-25g	25g	Available within 1-2 weeks(?) Item is derived from our semi-finished stock and is processed in 1-2 weeks.	$2,200.90
N183778-100g	100g	1	$7,922.90

Basic Description

Synonyms	AB04090 \| EN300-09381 \| FT-0612539 \| 3-Nitro-5-trifluoromethyl-1H-pyridin-2-one \| 1851650-55-9 \| 3-Nitro-5-(trifluoromethyl)-2(1H)-pyridinone \| 3-nitro-5-trifluoromethyl-pyridin-2-ol \| 3-nitro-5-trifluoromethylpyridin-2-ol \| CS-0157385 \| 2-hydroxy-3-nitro
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic 1,3-dipolar compounds
  - Class Allyl-type 1,3-dipolar organic compounds
    - Subclass Organic nitro compounds
      - Level5 C-nitro compounds
        Level6 Nitroaromatic compounds

Kingdom	Organic compounds
Superclass	Organic 1,3-dipolar compounds
Class	Allyl-type 1,3-dipolar organic compounds
Subclass	Organic nitro compounds
Intermediate Tree Nodes	C-nitro compounds
Direct Parent	Nitroaromatic compounds
Alternative Parents	Pyridinones Dihydropyridines Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Nitroaromatic compound - Dihydropyridine - Pyridinone - Hydropyridine - Pyridine - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic oxide - Organohalogen compound - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic 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

Pubchem Sid	504761892
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761892
IUPAC Name	3-nitro-5-(trifluoromethyl)-1H-pyridin-2-one
INCHI	InChI=1S/C6H3F3N2O3/c7-6(8,9)3-1-4(11(13)14)5(12)10-2-3/h1-2H,(H,10,12)
InChIKey	JYXKHKBZLLIWEV-UHFFFAOYSA-N
Smiles	C1=C(C(=O)NC=C1C(F)(F)F)[N+](=O)[O-]
Isomeric SMILES	C1=C(C(=O)NC=C1C(F)(F)F)[N+](=O)[O-]
Molecular Weight	208.1
Reaxy-Rn	13195518
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13195518&ln=

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

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

Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
J2431143	Certificate of Analysis	Nov 05, 2024	N183778
C2407318	Certificate of Analysis	Mar 14, 2024	N183778
K2322106	Certificate of Analysis	Dec 01, 2023	N183778
C1904091	Certificate of Analysis	Dec 12, 2022	N183778

Chemical and Physical Properties

Molecular Weight	208.090 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	208.01 Da
Monoisotopic Mass	208.01 Da
Topological Polar Surface Area	74.900 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	350.000
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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