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2-Phenyl-5-trifluoromethyl-2h-pyrazol-3-ol - 95%, high purity , CAS No.96145-98-1

COA

Grade & Purity:

≥95%

Cas Number: 96145-98-1
Molecular Weight: 228.2
PubChem CID: 892717

In stock

Item Number

P188887

Grouped product items
SKU	Size	Availability	Price
P188887-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
P188887-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$15.90
P188887-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90

Discover 2-Phenyl-5-trifluoromethyl-2h-pyrazol-3-ol by Aladdin Scientific in 95% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol \| 96145-98-1 \| 1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ol \| 2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one \| 781-93-1 \| 5-hydroxy-1-phenyl-3-trifluoromethylpyrazole \| 5-Hydroxy-1-phenyl-3-(trifluoromethyl)-1H-pyrazole \| 1H-Py
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Pyrazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Pyrazoles
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpyrazoles
Alternative Parents	Pyrazolones Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpyrazole - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Heteroaromatic compound - Vinylogous amide - Lactam - Azacycle - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl 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

IUPAC Name	2-phenyl-5-(trifluoromethyl)-1H-pyrazol-3-one
INCHI	InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-6,14H
InChIKey	PSQCMVQGPMFFCX-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)N2C(=O)C=C(N2)C(F)(F)F
Isomeric SMILES	C1=CC=C(C=C1)N2C(=O)C=C(N2)C(F)(F)F
PubChem CID	892717
Molecular Weight	228.2

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	228.170 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	228.051 Da
Monoisotopic Mass	228.051 Da
Topological Polar Surface Area	32.299 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	319.000
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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