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5-(chloromethyl)-1,3-dimethyl-1H-pyrazole - 97%, high purity , CAS No.852227-86-2

COA

Grade & Purity:

≥97%

Cas Number: 852227-86-2
Molecular Weight: 144.602
PubChem CID: 4961270
PubChem SID: 488195031

In stock

Item Number

C177652

Grouped product items
SKU	Size	Availability	Price
C177652-1g	1g	8	$55.90
C177652-5g	5g	6	$184.90
C177652-25g	25g	1	$735.90

Discover 5-(chloromethyl)-1,3-dimethyl-1H-pyrazole by Aladdin Scientific in 97% for only $55.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	5-(chloromethyl)-1,3-dimethyl-1H-pyrazole \| 852227-86-2 \| 5-(chloromethyl)-1,3-dimethylpyrazole \| 1H-Pyrazole, 5-(chloromethyl)-1,3-dimethyl- \| MFCD07368502 \| 5-Chloromethyl-1,3-dimethyl-1H-pyrazole \| SCHEMBL343813 \| DTXSID60406903 \| SGEZKPNUNBVVLB-UHFFFAOYSA-N \| BCP23450 \|
Specifications & Purity	≥97%
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	Pyrazoles
Alternative Parents	Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - 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

Pubchem Sid	488195031
IUPAC Name	5-(chloromethyl)-1,3-dimethylpyrazole
INCHI	InChI=1S/C6H9ClN2/c1-5-3-6(4-7)9(2)8-5/h3H,4H2,1-2H3
InChIKey	SGEZKPNUNBVVLB-UHFFFAOYSA-N
Smiles	CC1=NN(C(=C1)CCl)C
Isomeric SMILES	CC1=NN(C(=C1)CCl)C
Molecular Weight	144.602
Reaxy-Rn	15031983
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15031983&ln=

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.

6 results found

Lot Number	Certificate Type	Date	Item
E2330518	Certificate of Analysis	Apr 26, 2023	C177652
E2330515	Certificate of Analysis	Apr 26, 2023	C177652
E2330522	Certificate of Analysis	Apr 26, 2023	C177652
E2330523	Certificate of Analysis	Apr 26, 2023	C177652
E2330525	Certificate of Analysis	Apr 26, 2023	C177652
E2330521	Certificate of Analysis	Apr 26, 2023	C177652

Chemical and Physical Properties

Molecular Weight	144.600 g/mol
XLogP3	1.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	144.045 Da
Monoisotopic Mass	144.045 Da
Topological Polar Surface Area	17.800 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	97.100
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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