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6-Methoxy-7-nitro-1-indanone - 97%, high purity , CAS No.196597-96-3

COA

Grade & Purity:

≥97%

Cas Number: 196597-96-3
Molecular Weight: 207.18
MDL number: MFCD06008300
PubChem CID: 11790408

In stock

Item Number

M168293

Grouped product items
SKU	Size	Availability	Price	Qty
M168293-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$55.90
M168293-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$212.90

Discover 6-Methoxy-7-nitro-1-indanone by Aladdin Scientific in 97% for only $55.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	DTXSID80472847 \| 6-Methoxy-7-nitro-1-indanone \| 2,3-dihydro-6-methoxy-7-nitro-1H-Inden-1-one \| SCHEMBL4688521 \| 6-Methoxy-7-nitro-1-indanone, 97% \| AMY27987 \| FT-0656601 \| 6-Methoxy-7-nitro-2,3-dihydro-1H-inden-1-one \| AKOS015852092 \| 6-methoxy-7-nitro-2,
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Indanes
    - Subclass Indanones

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Indanes
Subclass	Indanones
Intermediate Tree Nodes	Not available
Direct Parent	Indanones
Alternative Parents	Methoxyanilines Nitroaromatic compounds Aryl alkyl ketones Anisoles Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Indanone - Methoxyaniline - Nitroaromatic compound - Anisole - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Ketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Ether - Organic 1,3-dipolar compound - Organic zwitterion - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organic salt - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane 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

Names and Identifiers

IUPAC Name	6-methoxy-7-nitro-2,3-dihydroinden-1-one
INCHI	InChI=1S/C10H9NO4/c1-15-8-5-3-6-2-4-7(12)9(6)10(8)11(13)14/h3,5H,2,4H2,1H3
InChIKey	VJEWECISSPCJAV-UHFFFAOYSA-N
Smiles	COC1=C(C2=C(CCC2=O)C=C1)[N+](=O)[O-]
Isomeric SMILES	COC1=C(C2=C(CCC2=O)C=C1)[N+](=O)[O-]
WGK Germany	3
Molecular Weight	207.18
Reaxy-Rn	9261229
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9261229&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	157-161 °C
Molecular Weight	207.180 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	207.053 Da
Monoisotopic Mass	207.053 Da
Topological Polar Surface Area	72.100 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	286.000
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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