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(3-methyl-1H-pyrazol-5-yl)methanol - 97%, high purity , CAS No.29004-73-7

COA

Grade & Purity:

≥97%

Cas Number: 29004-73-7
Molecular Weight: 112.13
PubChem CID: 730093

In stock

Item Number

M588591

Grouped product items
SKU	Size	Availability	Price
M588591-100mg	100mg	3	$22.90
M588591-250mg	250mg	3	$45.90
M588591-1g	1g	2	$149.90

Basic Description

Synonyms	3-Methyl-1H-pyrazol-5-yl)methanol \| 5-METHYL-1H-PYRAZOLE-3-METHANOL \| DS-13449 \| SB13732 \| STK054548 \| F3145-1242 \| AC-27316 \| MFCD00159583 \| A881535 \| BB 0257632 \| SYDSMFCVIJNHEN-UHFFFAOYSA-N \| AKOS000491202 \| (3-methyl-1H-pyrazol-5-yl)methanol \| 1H-Pyra
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Desiccated
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 Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic alcohol - 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

Names and Identifiers

IUPAC Name	(5-methyl-1H-pyrazol-3-yl)methanol
INCHI	InChI=1S/C5H8N2O/c1-4-2-5(3-8)7-6-4/h2,8H,3H2,1H3,(H,6,7)
InChIKey	SYDSMFCVIJNHEN-UHFFFAOYSA-N
Smiles	CC1=CC(=NN1)CO
Isomeric SMILES	CC1=CC(=NN1)CO
Molecular Weight	112.13
Reaxy-Rn	1972
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1972&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
I2314120	Certificate of Analysis	Aug 31, 2023	M588591
I2314122	Certificate of Analysis	Aug 31, 2023	M588591
I2314121	Certificate of Analysis	Aug 31, 2023	M588591

Chemical and Physical Properties

Molecular Weight	112.130 g/mol
XLogP3	-0.200
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
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	76.800
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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