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3-(Difluoromethyl)-5-methyl-1h-pyrazole - 97%, high purity , CAS No.934759-09-8

COA

Grade & Purity:

≥97%

Cas Number: 934759-09-8
Molecular Weight: 132.1
PubChem CID: 2782520

In stock

Item Number

D188393

Grouped product items
SKU	Size	Availability	Price	Qty
D188393-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$153.90
D188393-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$435.90

Basic Description

Synonyms	3-(difluoromethyl)-5-methyl-1H-pyrazole \| 934759-09-8 \| 936033-61-3 \| 5-(Difluoromethyl)-3-methyl-1H-pyrazole \| 3-Difluoromethyl-5-methyl-1H-pyrazole \| 3-(Difluoromethyl)-5-methylpyrazole \| 3(5)-Difluoromethyl-5(3)-methylpyrazole \| MFCD04039283 \| 5-difluoromethyl-3-methy
Specifications & Purity	≥97%
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	Pyrazoles
Alternative Parents	Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three carbon atoms.
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	3-(difluoromethyl)-5-methyl-1H-pyrazole
INCHI	InChI=1S/C5H6F2N2/c1-3-2-4(5(6)7)9-8-3/h2,5H,1H3,(H,8,9)
InChIKey	QPGWGHWOAIFIPR-UHFFFAOYSA-N
Smiles	CC1=CC(=NN1)C(F)F
Isomeric SMILES	CC1=CC(=NN1)C(F)F
Molecular Weight	132.1
Reaxy-Rn	38282501
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=38282501&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	132.110 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	132.05 Da
Monoisotopic Mass	132.05 Da
Topological Polar Surface Area	28.700 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	97.000
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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