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3-(tert-Butyl)-1H-pyrazole-5-carbohydrazide - ≥98%, high purity , CAS No.262292-02-4

COA

Grade & Purity:

≥98%

Cas Number: 262292-02-4
Molecular Weight: 182.23
PubChem CID: 718956

In stock

Item Number

H698804

Grouped product items
SKU	Size	Availability	Price	Qty
H698804-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$230.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Pyrazoles
      - Level5 Pyrazole carboxylic acids and derivatives
        Level6 Pyrazole-5-carboxamides

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Pyrazoles
Intermediate Tree Nodes	Pyrazole carboxylic acids and derivatives
Direct Parent	Pyrazole-5-carboxamides
Alternative Parents	Heteroaromatic compounds Carboxylic acid hydrazides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyrazole-5-carboxamide - Heteroaromatic compound - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyrazole-5-carboxamides. These are compounds containing a pyrazole ring that carries a carboxamide group at the 4-position.
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-tert-butyl-1H-pyrazole-3-carbohydrazide
INCHI	InChI=1S/C8H14N4O/c1-8(2,3)6-4-5(11-12-6)7(13)10-9/h4H,9H2,1-3H3,(H,10,13)(H,11,12)
InChIKey	ZJFRMJHBYDBUGG-UHFFFAOYSA-N
Smiles	CC(C)(C)C1=CC(=NN1)C(=O)NN
Isomeric SMILES	CC(C)(C)C1=CC(=NN1)C(=O)NN
PubChem CID	718956
Molecular Weight	182.23

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	182.220 g/mol
XLogP3	0.800
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	182.117 Da
Monoisotopic Mass	182.117 Da
Topological Polar Surface Area	83.800 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	199.000
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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