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2-(1H-Pyrazol-4-yl)ethanol - 98%, high purity , CAS No.180207-57-2

COA

Grade & Purity:

≥98%

Cas Number: 180207-57-2
Molecular Weight: 112.13
EC Number: 855-656-8
PubChem CID: 4293604

In stock

Item Number

H587730

Grouped product items
SKU	Size	Availability	Price
H587730-1g	1g	3	$29.90
H587730-5g	5g	2	$121.90
H587730-25g	25g	2	$453.90

Basic Description

Synonyms	2-(1H-Pyrazol-4-Yl)Ethan-1-Ol \| STK301539 \| CL3409 \| AB14476 \| 1H-Pyrazole-4-ethanol \| BB 0259369 \| AB01333770-02 \| BCP22854 \| W-206279 \| 2-(1H-pyrazol-4-yl) ethanol \| AKOS000307363 \| AC-23295 \| A3994 \| EN300-110521 \| AM20090062 \| 2-(4-pyrazolyl)ethanol \|
Specifications & Purity	≥98%
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 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 Primary alcohols Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - 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

Mechanisms of Action

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

Names and Identifiers

IUPAC Name	2-(1H-pyrazol-4-yl)ethanol
INCHI	InChI=1S/C5H8N2O/c8-2-1-5-3-6-7-4-5/h3-4,8H,1-2H2,(H,6,7)
InChIKey	YVQFZSHMTCZYMI-UHFFFAOYSA-N
Smiles	C1=C(C=NN1)CCO
Isomeric SMILES	C1=C(C=NN1)CCO
Alternate CAS	180207-57-2
Molecular Weight	112.13
Reaxy-Rn	108496
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=108496&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.

4 results found

Lot Number	Certificate Type	Date	Item
I2325628	Certificate of Analysis	Sep 07, 2023	H587730
I2325629	Certificate of Analysis	Sep 07, 2023	H587730
I2325600	Certificate of Analysis	Sep 07, 2023	H587730
I2325603	Certificate of Analysis	Sep 07, 2023	H587730

Chemical and Physical Properties

Molecular Weight	112.130 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	112.064 Da
Monoisotopic Mass	112.064 Da
Topological Polar Surface Area	48.900 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	67.400
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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