6072-57-7

Basic information

• Product Name: 3-METHYLINDAN-1-ONE
• Synonyms: AKOS BC-0392;3-METHYLINDAN-1-ONE;(R,S)-3-Methyl-indan-1-one;3-Methyl-2,3-dihydro-1H-indene-1-one;3-Methyl-1-indanone;3-Methyl-2,3-dihydroinden-1-one;2,3-Dihydro-3-methyl-1H-inden-1-one, 2,3-Dihydro-3-methyl-1-oxo-1H-indene;3-Methyl-1-indanone 99%
• CAS NO: 6072-57-7
• Molecular Formula: C₁₀H₁₀O
• Molecular Weight: 146.19
• Product Categories: Indanone & Indene;C10;Carbonyl Compounds;Ketones;Building Blocks;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks
• Mol File: 6072-57-7.mol
• Article Data: 40

Chemical Properties

• Boiling Point: 70-72 °C0.7 mm Hg(lit.)
• Flash Point: >230 °F
• Appearance: /
• Density: 1.075 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.558(lit.)
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 3-METHYLINDAN-1-ONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-METHYLINDAN-1-ONE(6072-57-7)
• EPA Substance Registry System: 3-METHYLINDAN-1-ONE(6072-57-7)

Safety Data

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 22-26-36/37/39
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 6072-57-7(Hazardous Substances Data)

Usage

Uses

3-Methyl-1-indanone is suitable for the synthesis of branched alkyl indanes (BINs). It may be used in the following studies:Synthesis of 2,2,3-tribromo-2,3-dihydro-3-methylinden-1-one and 2-bromo-3-bromomethyl-1H-inden-1-one. As photosensitizers for the splitting of dimethylthymine dimers. As a model to verify three-phase model in enantioselective gas-liquid chromatography.(-)-(R)-3-methyl-1-indanone may be used as standard for comparing the optical rotatory dispersion curve with 1,3-dialkylindenes in the study of base-catalyzed 1,3 proton transfer in indene systems.As an optically active sensitizer to induce asymmetry in trans-1,2-diphenylcylcopropane (DPC). The dl-isomers of 3-methyl-1-indanone may be used in the synthesis of monomeric and trimeric 3-methyl-1-indanethione.

Synthesis Reference(s)

Journal of the American Chemical Society, 65, p. 59, 1943 DOI: 10.1021/ja01241a020

General Description

3-Methyl-1-indanone is a derivative of 1-indanone.Its synthesis has been reported. The 1H and 13C-NMR spectra of 3-methyl-1-indanone has been reported. Biocatalyzed oxidation of racemic 3-methyl-1-indanone with high enanatioselectivity has been investigated.

InChI:InChI=1/C18H13F5N4OS/c19-9-3-4-12(11(20)6-9)26-17(28)10-8-24-27-15(18(21,22)23)7-13(25-16(10)27)14-2-1-5-29-14/h1-6,8,13,15,24H,7H2,(H,26,28)

Upstream product

• 56661-85-9 4-methyl-1-oxo-1H-isothiochromene-3-carboxylic acid 
• 495-41-0 1-phenylbut-2-en-1-one 
• 1134-71-0 ethyl 3-phenylbutanoate 
• 10487-71-5 crotonyl chloride 
• 71-43-2 benzene 
• 107-93-7 (E)-but-2-enoic acid 
• 4593-90-2 3-phenylbutyric acid 
• 939-52-6 4-chloro-1-phenylbutan-1-one 
• 3724-65-0 2-butenoic acid 
• 625-35-4 trans-chrotonyl chloride 
• 64-17-5 ethanol 
• 7446-70-0 aluminium trichloride 
• 86119-84-8 phosphoric acid 
• 7664-93-9 sulfuric acid 

Downstream Products

• 2177-48-2 1,3-dimethyl-1H-indene 
• 40570-19-2 2-(1-carboxyethyl)benzoic acid 
• 5706-41-2 2-benzylidene-3-methyl-2,3-dihydro-1H-inden-1-one 
• 5706-39-8 2-(4-methoxybenzylidene)-3-methyl-2,3-dihydro-1H-inden-1-one 
• 24273-33-4 3-Methyl-1,2-indandion-2-oxim 
• 5706-36-5 2-(4-chlorobenzylidene)-3-methyl-2,3-dihydro-1H-inden-1-one 
• 5706-37-6 2-(2-Chlor-benzyliden)-3-methyl-indan-1-on 
• 5706-40-1 2-<2-Methoxy-benzyliden>-3-methyl-indan-1-on 
• 6072-56-6 2-(3,4-Dichlor-benzyliden)-3-methyl-indan-1-on 
• 82252-93-5 2t-Benzyl-1r-methyl-2c-indancarbaldehyd 
• 82252-92-4 2t-Benzyl-1r-methyl-2c-indanmethanol 
• 82252-94-6 2t-Benzyl-1r-methyl-2c-indancarbonsaeure 
• 82252-90-2 2t-Benzyl-2c-(hydroxymethyl)-3r-methyl-1-indanol 
• 82252-91-3 2c-(Acetoxymethyl)-2t-benzyl-1r-methylindan 

Relevant articles and documents

Nickel-Catalyzed Ring Expansion of Cyclobutanones towards Indanones

Despite recent advances in catalytic ring-opening/cross-coupling process of o-halogen tethered phenylcyclobutanones with other partners, single-component ring expansion of such precursors towards 3-methylindanones has not been disclosed. We present herein a nickel catalyzed C?C bond reconstruction sequence of o-bromophenylcyclobutanones using H2O as hydrogen donor, leading to a series of indanones, which can be further converted into other benzene-fused cyclic compounds.

Exploring the synthetic potential of a marine transaminase including discrimination at a remote stereocentre

The marine transaminase, P-ω-TA, can be employed for the transamination from 1-aminotetralins and 1-aminoindanes with differentiation of stereochemistry at both the site of reaction and at a remote stereocentre resulting in formation of ketone products with up to 93% ee. While 4-substituents are tolerated on the tetralin core, the presence of 3- or 8-substituents is not tolerated by the transaminase. In general P-ω-TA shows capacity for remote diastereoselectivity, although both the stereoselectivity and efficiency are dependent on the specific substrate structure. Optimum efficiency and selectivity are seen with 4-haloaryl-1-aminotetralins and 3-haloaryl-1-aminoindanes, which may be associated with the marine origin of this enzyme. This journal is

One-pot multicomponent synthesis and antimicrobial evaluation of novel tricyclic indenopyrimidine-2-amines

The synthesis of novel tricyclic indenopyrimidine-2-amines from 3,3-dimethyl-/3-methyl-2H-indanones has achieved by base-catalyzed one-pot three-component reaction. The desired products are formed within 10 hours after addition at reflux temperature. This