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2-Aminocyclohepta-2，4，6-trienone - ≥97%, high purity , CAS No.6264-93-3

COA

Grade & Purity:

≥97%

Cas Number: 6264-93-3
Molecular Weight: 121.14
PubChem CID: 22634

In stock

Item Number

A693766

Grouped product items
SKU	Size	Availability	Price
A693766-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$406.90
A693766-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$645.90
A693766-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,038.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbon derivatives
  - Class Tropones

Kingdom	Organic compounds
Superclass	Hydrocarbon derivatives
Class	Tropones
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Tropones
Alternative Parents	Cyclic ketones Primary amines Organopnictogen compounds Organic oxides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Tropone - Cyclic ketone - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as tropones. These are compounds containing a tropone ring, which is a cycloheptatrienone ring bearing a ketone group.
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-aminocyclohepta-2,4,6-trien-1-one
INCHI	InChI=1S/C7H7NO/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H2,8,9)
InChIKey	PIOPKWFBKZTUMS-UHFFFAOYSA-N
Smiles	C1=CC=C(C(=O)C=C1)N
Isomeric SMILES	C1=CC=C(C(=O)C=C1)N
PubChem CID	22634
Molecular Weight	121.14

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	121.140 g/mol
XLogP3	0.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	121.053 Da
Monoisotopic Mass	121.053 Da
Topological Polar Surface Area	43.100 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	211.000
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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