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5-chloro-1-methyl-4-nitro-pyrazole - 97%, high purity , CAS No.42098-25-9

COA

Grade & Purity:

≥97%

Cas Number: 42098-25-9
Molecular Weight: 161.55
EC Number: 817-771-1
MDL number: MFCD21607270
PubChem CID: 12344836

In stock

Item Number

C633864

Grouped product items
SKU	Size	Availability	Price
C633864-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
C633864-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
C633864-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$65.90
C633864-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$289.90
C633864-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$499.90

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Organic building blocks (409)

Basic Description

Synonyms	BCP15591 \| AM806567 \| AKOS016000438 \| SY040265 \| AC-31217 \| MFCD21607270 \| EN300-156975 \| 5-chloro-1-methyl-4-nitropyrazole \| 5-chloro-1-methyl-4-nitro-pyrazole \| 5-chloro-1-Methyl-4-nitro-1H-pyrazole \| 3-chloro-2-methyl-4-nitro-pyrazole \| POXLZEWCWNUVDW-
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

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	Aryl chlorides Pyrazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Nitroaromatic compound - Aryl chloride - Aryl halide - Azole - Pyrazole - Heteroaromatic compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Organic cation - 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

IUPAC Name	5-chloro-1-methyl-4-nitropyrazole
INCHI	InChI=1S/C4H4ClN3O2/c1-7-4(5)3(2-6-7)8(9)10/h2H,1H3
InChIKey	POXLZEWCWNUVDW-UHFFFAOYSA-N
Smiles	CN1C(=C(C=N1)[N+](=O)[O-])Cl
Isomeric SMILES	CN1C(=C(C=N1)[N+](=O)[O-])Cl
Alternate CAS	42098-25-9
PubChem CID	12344836
Molecular Weight	161.55

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
F2513268	Certificate of Analysis	Nov 15, 2024	C633864
F2513269	Certificate of Analysis	Nov 15, 2024	C633864
F2513291	Certificate of Analysis	Nov 15, 2024	C633864
F2513292	Certificate of Analysis	Nov 15, 2024	C633864
F2513293	Certificate of Analysis	Nov 15, 2024	C633864
F2513294	Certificate of Analysis	Nov 15, 2024	C633864
F2513302	Certificate of Analysis	Nov 15, 2024	C633864
F2513303	Certificate of Analysis	Nov 15, 2024	C633864

Chemical and Physical Properties

Sensitivity	Light sensitive
Molecular Weight	161.550 g/mol
XLogP3	1.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	160.999 Da
Monoisotopic Mass	160.999 Da
Topological Polar Surface Area	63.600 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	148.000
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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