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3-Methyl-1-phenylpyrazole - 98%, high purity , CAS No.1128-54-7

COA

Grade & Purity:

≥98%

Cas Number: 1128-54-7
Molecular Weight: 158.2
MDL number: MFCD00003123
PubChem CID: 70783
PubChem SID: 488184594

In stock

Item Number

M158361

Grouped product items
SKU	Size	Availability	Price
M158361-1g	1g	9	$83.90
M158361-5g	5g	3	$309.90
M158361-10g	10g	1	$550.90
M158361-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,236.90

Basic Description

Synonyms	3-Methyl-1-phenyl-1H-pyrazole \| 1128-54-7 \| 3-Methyl-1-phenylpyrazole \| 1-Phenyl-3-methylpyrazole \| Pyrazole, 3-methyl-1-phenyl- \| 1H-Pyrazole, 3-methyl-1-phenyl- \| MFCD00003123 \| 1H-Pyrazole, methylphenyl- \| 1H-Pyrazole,3-Methyl-1-phenyl- \| EINECS 214-438-7 \| NSC163372 \| NSC
Specifications & Purity	≥98%
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	Benzene and substituted derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpyrazole - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - 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

Pubchem Sid	488184594
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184594
IUPAC Name	3-methyl-1-phenylpyrazole
INCHI	InChI=1S/C10H10N2/c1-9-7-8-12(11-9)10-5-3-2-4-6-10/h2-8H,1H3
InChIKey	RJXLUGSJEMSDPK-UHFFFAOYSA-N
Smiles	CC1=NN(C=C1)C2=CC=CC=C2
Isomeric SMILES	CC1=NN(C=C1)C2=CC=CC=C2
Molecular Weight	158.2
Reaxy-Rn	117870
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=117870&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.

5 results found

Lot Number	Certificate Type	Date	Item
L2410159	Certificate of Analysis	Dec 18, 2024	M158361
L2410183	Certificate of Analysis	Dec 17, 2024	M158361
D2320250	Certificate of Analysis	Aug 09, 2022	M158361
J1818023	Certificate of Analysis	Aug 09, 2022	M158361
J1818022	Certificate of Analysis	Aug 09, 2022	M158361

Chemical and Physical Properties

Molecular Weight	158.200 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	158.084 Da
Monoisotopic Mass	158.084 Da
Topological Polar Surface Area	17.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	141.000
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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