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1-(2,2-difluoroethyl)-1H-pyrazol-3-amine - 97%, high purity , CAS No.1006462-38-9

COA

Grade & Purity:

≥97%

Cas Number: 1006462-38-9
Molecular Weight: 147.13
EC Number: 877-989-8
PubChem CID: 19622830

In stock

Item Number

H626495

Grouped product items
SKU	Size	Availability	Price
H626495-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$92.90
H626495-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$406.90
H626495-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$811.90

Basic Description

Synonyms	AKOS000313950 \| Z608352698 \| SCHEMBL12610063 \| 1-(2,2-difluoroethyl)pyrazol-3-amine \| AC1199 \| 1006462-38-9 \| A910847 \| IEUJFYRUNRRGQY-UHFFFAOYSA-N \| EN300-99813 \| SY084636 \| MFCD08696542 \| 1-(2,2-difluoroethyl)-1H-pyrazol-3-amine \| AB90191 \| STK351296 \|
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Imidolactams

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Imidolactams
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Imidolactams
Alternative Parents	Pyrazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Imidolactam - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as imidolactams. These are cyclic organooxygen compounds containing the structure RC(=N)N where the central carbon atom and one of the linked nitrogen atoms are part of the same ring( R here is an organyl group). They can also be viewed as analogs of lactams where the oxygen atom is replaced by a nitrogen atom.
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	1-(2,2-difluoroethyl)pyrazol-3-amine
INCHI	InChI=1S/C5H7F2N3/c6-4(7)3-10-2-1-5(8)9-10/h1-2,4H,3H2,(H2,8,9)
InChIKey	IEUJFYRUNRRGQY-UHFFFAOYSA-N
Smiles	C1=CN(N=C1N)CC(F)F
Isomeric SMILES	C1=CN(N=C1N)CC(F)F
Alternate CAS	1006462-38-9
PubChem CID	19622830
Molecular Weight	147.13

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	147.130 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	147.061 Da
Monoisotopic Mass	147.061 Da
Topological Polar Surface Area	43.800 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	109.000
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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