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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12O3
Molecular Weight 192.2112
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,6-DIMETHOXY-1-INDANONE

SMILES

COC1=CC2=C(C=C1OC)C(=O)CC2

InChI

InChIKey=IHMQOBPGHZFGLC-UHFFFAOYSA-N
InChI=1S/C11H12O3/c1-13-10-5-7-3-4-9(12)8(7)6-11(10)14-2/h5-6H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C11H12O3
Molecular Weight 192.2112
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

5,6-Dimethoxy-1-Indanone is used for the organic synthesis. It is an intermediate useful in the preparation of acetylcholinesterase inhibitor Donepezil. 5,6-Dimethoxy-1-Indanone derivatives displayed a potent suppression of the hepatitis C virus (HCV) replication and inhibition of bovine viral diarrhea virus RNA synthesis.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Synthesis of novel, potentially biologically active dibenzosuberone derivatives.
2005 Dec 31
Simple and regioselective bromination of 5,6-disubstituted-indan-1-ones with Br2 under acidic and basic conditions.
2007 Jan 29
Methyl 5,6-dimeth-oxy-1H-indole-2-carboxyl-ate.
2009 Sep 5
(2E)-2-Benzyl-idene-5,6-dimethoxy-indan-1-one.
2010 Sep 11
Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:49:32 GMT 2023
Edited
by admin
on Sat Dec 16 08:49:32 GMT 2023
Record UNII
F805RZI8GO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,6-DIMETHOXY-1-INDANONE
Systematic Name English
1H-INDEN-1-ONE, 2,3-DIHYDRO-5,6-DIMETHOXY-
Systematic Name English
5,6-DIMETHOXY-2,3-DIHYDRO-1H-INDEN-1-ONE
Systematic Name English
DONEPEZIL HYDROCHLORIDE MONOHYDRATE IMPURITY B [EP IMPURITY]
Common Name English
DONEPEZIL HYDROCHLORIDE IMPURITY B [EP IMPURITY]
Common Name English
NSC-401450
Code English
5,6-DIMETHOXYINDANE-1-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
F805RZI8GO
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID9057680
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
NSC
401450
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
PUBCHEM
75018
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
CAS
2107-69-9
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
ECHA (EC/EINECS)
218-287-8
Created by admin on Sat Dec 16 08:49:33 GMT 2023 , Edited by admin on Sat Dec 16 08:49:33 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP