2-(2,3-dihydro-1H-inden-2-yl)acetic Acid

Base Information

• Chemical Name: 2-(2,3-dihydro-1H-inden-2-yl)acetic Acid
• CAS No.: 37868-26-1
• Molecular Formula: C11H12 O2
• Molecular Weight: 176.215
• Hs Code.: 2916399090
• European Community (EC) Number: 670-419-7
• DSSTox Substance ID: DTXSID10409166
• Wikidata: Q72482746
• Mol file: 37868-26-1.mol

Synonyms:37868-26-1;2-(2,3-dihydro-1H-inden-2-yl)acetic Acid;2-INDANYLACETIC ACID;INDAN-2-YL-ACETIC ACID;2-indaneacetic acid;Indan-2-ylacetic acid;2,3-DIHYDRO-1H-INDENE-2-ACETIC ACID;MFCD00082653;1H-INDENE-2-ACETIC ACID, 2,3-DIHYDRO-;indan-2-acetic acid;2,3-dihydro-1H-inden-2-ylacetic acid;indan-2-yl acetic acid;(indan-2-yl)acetic acid;2-(indan-2-yl)acetic acid;SCHEMBL1340255;DTXSID10409166;AM9960;AKOS009158243;AB03118;CS-W007054;BS-27979;SY106504;2-(2,3-dihydro-1H-inden-2-yl)aceticacid;FT-0612648;2-(2,3-dihydro-1H-inden-2-yl)ethanoic acid;A823908

Chemical Property of 2-(2,3-dihydro-1H-inden-2-yl)acetic Acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 91-93oC
• Boiling Point: 343.28oC at 760 mmHg
• PKA: 4.70±0.10(Predicted)
• Flash Point: 240.264oC
• PSA: 37.30000
• Density: 1.169g/cm3
• LogP: 2.19110
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility.: Insoluble in water.
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 176.083729621
• Heavy Atom Count: 13
• Complexity: 186

Purity/Quality:

97% ^*data from raw suppliers

2-IndanylaceticAcid ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Useful:

• Canonical SMILES: C1C(CC2=CC=CC=C21)CC(=O)O
• Uses: 2-Indanylacetic acid is the starting material in the synthesis of pentacylic core of (+)-Salvileucalin.

Technology Process of 2-(2,3-dihydro-1H-inden-2-yl)acetic Acid

There total 9 articles about 2-(2,3-dihydro-1H-inden-2-yl)acetic Acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.0%

3,3a,4,8b-tetrahydroindeno<1,2-b>furan-2-one (4471-33-4,70667-72-0,78646-74-9) → 2-(indan-2-yl)acetic acid (37868-26-1)

Guidance literature:

With palladium on activated carbon; hydrogen; In methanol; at 20 ℃; for 12h; under 760.051 Torr; Schlenk technique;

DOI:10.1021/acs.orglett.9b02673

Reference yield: 90.0%

1-oxoindan-Δ2,α-acetic acid (114915-75-2) → 2-(indan-2-yl)acetic acid (37868-26-1)

Guidance literature:

With palladium on activated charcoal; hydrogen; for 24h; under 15514.9 Torr;

DOI:10.1021/jo500164x

Reference yield:

(E)-2-(1-oxo-1,3-dihydro-2H-inden-2-ylidene)acetic acid (157406-12-7) → 2-(indan-2-yl)acetic acid (37868-26-1)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In 1,4-dioxane; methanol; for 16h; under 2068.65 Torr;

DOI:10.1021/jm800967h

upstream raw materials:

1-oxoindan-Δ^2,α-acetic acid

inden-1-one

(E)-2-(1-oxo-1,3-dihydro-2H-inden-2-ylidene)acetic acid

2-indanone

Downstream raw materials:

2-(indan-2-yl)ethanol

ethyl 2-indanylacetate

2-(2,3,4,7-tetrahydro-1H-inden-2-yl)acetic acid

2-(benzyloxycarbonylaminomethyl)indane