Skip to the beginning of the images gallery

1-Phenylpyrazole - >98.0%(GC), high purity , CAS No.1126-00-7

COA

Grade & Purity:

≥98%(GC)

Cas Number: 1126-00-7
Molecular Weight: 144.18
Beilstein Registry Number: 23(5)4,138
MDL number: MFCD00003112
PubChem CID: 70769
PubChem SID: 488184592

In stock

Item Number

P160449

Grouped product items
SKU	Size	Availability	Price
P160449-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
P160449-5g	5g	5	$20.90
P160449-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$37.90
P160449-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$69.90
P160449-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$249.90

View related series

Five-Membered Heterocyclic Compounds (2064) Pyrazoles (228)

Basic Description

Synonyms	BCP21822 \| N-(1-naphthyl)piperazine \| AKOS000314036 \| J-505096 \| UNII-SD5GA7KV5R \| P1868 \| SY008038 \| FT-0633373 \| 1H-Pyrazole, 1-phenyl- \| 1-Phenylpyrazole \| 1-phenyl-pyrazole \| EINECS 214-415-1 \| AMY11895 \| InChI=1/C9H8N2/c1-2-5-9(6-3-1)11-8-4-7-10-11/h
Specifications & Purity	≥98%(GC)
Shipped In	Normal
Product Description	1-Phenylpyrazole has been used: · in the preparation of 4,5-diphenylpyrazolo[1,5-a]quinoline, 1-(1,2,3,4-tetraphenylnaphthalen-5-yl)pyrazole and 1-(1,2,3,4,5,6,7,8-octaphenylanthracen-9-yl)pyrazole · as cyclometallated ligand in the preparation of new heteroleptic iridium(III) complexes

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	pyrazoles - benzenes
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488184592
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184592
IUPAC Name	1-phenylpyrazole
INCHI	InChI=1S/C9H8N2/c1-2-5-9(6-3-1)11-8-4-7-10-11/h1-8H
InChIKey	WITMXBRCQWOZPX-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)N2C=CC=N2
Isomeric SMILES	C1=CC=C(C=C1)N2C=CC=N2
WGK Germany	3
PubChem CID	70769
Molecular Weight	144.18
Beilstein	23(5)4,138
Reaxy-Rn	2594

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
C2520368	Certificate of Analysis	Dec 12, 2024	P160449
C2531418	Certificate of Analysis	Dec 12, 2024	P160449
C2531425	Certificate of Analysis	Dec 12, 2024	P160449
C2531439	Certificate of Analysis	Dec 12, 2024	P160449
B2208076	Certificate of Analysis	Feb 14, 2022	P160449
B2208075	Certificate of Analysis	Aug 06, 2021	P160449
D2325095	Certificate of Analysis	Aug 06, 2021	P160449
L2420101	Certificate of Analysis	Aug 06, 2021	P160449

Chemical and Physical Properties

Solubility	Soluble in water.
Refractive Index	1.6
Flash Point(°F)	228 °F
Flash Point(°C)	109 °C
Boil Point(°C)	142°C/30mmHg(lit.)
Melt Point(°C)	11°C
Molecular Weight	144.170 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	144.069 Da
Monoisotopic Mass	144.069 Da
Topological Polar Surface Area	17.800 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	119.000
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

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration