5-Methoxy-2,3-dihydro-1h-inden-1-ol

Base Information

• Chemical Name: 5-Methoxy-2,3-dihydro-1h-inden-1-ol
• CAS No.: 3199-77-7
• Molecular Formula: C10H12 O2
• Molecular Weight: 164.204
• Hs Code.: 2909499000
• NSC Number: 80580
• DSSTox Substance ID: DTXSID00292160
• Nikkaji Number: J1.764.858F
• Mol file: 3199-77-7.mol

Synonyms:5-methoxy-2,3-dihydro-1h-inden-1-ol;3199-77-7;1H-Inden-1-ol,2,3-dihydro-5-methoxy-;5-methoxy-1-indanol;5-Methoxyindan-1-ol;5-Methoxyindanol;NSC80580;SCHEMBL607389;DTXSID00292160;DDCHXICIPBSSAX-UHFFFAOYSA-N;NSC-80580;AKOS006309605;BS-42543;FT-0760970;2,3-DIHYDRO-5-METHOXY-1H-INDEN-1-OL;N14435

Chemical Property of 5-Methoxy-2,3-dihydro-1h-inden-1-ol

Chemical Property:

• Vapor Pressure: 0.000308mmHg at 25°C
• Boiling Point: 307.8°C at 760 mmHg
• Flash Point: 144.1°C
• PSA: 29.46000
• Density: 1.176g/cm³
• LogP: 1.67480
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 164.083729621
• Heavy Atom Count: 12
• Complexity: 158

Purity/Quality:

99% ^*data from raw suppliers

5-methoxy-2,3-dihydro-1H-inden-1-ol 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)C(CC2)O

Technology Process of 5-Methoxy-2,3-dihydro-1h-inden-1-ol

There total 7 articles about 5-Methoxy-2,3-dihydro-1h-inden-1-ol 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: 95.0%

5-methoxy-1-indanone (5111-70-6) → 5-methoxy-2,3-dihydro-1H-inden-1-ol (3199-77-7)

Guidance literature:

With sodium tetrahydroborate; water; In tetrahydrofuran; at 20 ℃; for 2h;

Reference yield:

5-methoxyindan-1-yl 3,5-dinitrobenzoate (79827-88-6) → 3,5-dinitrobenzoic acid (99-34-3) + 5-methoxy-2,3-dihydro-1H-inden-1-ol (3199-77-7)

Guidance literature:

With water; In acetone; at 21.2 ℃; Rate constant; Kinetics; other temp.;

DOI:10.1021/jo00341a027

Reference yield:

3-(3-Methoxy-phenyl)-propionic acid (10516-71-9) → 5-methoxy-2,3-dihydro-1H-inden-1-ol (3199-77-7)

Guidance literature:

Multi-step reaction with 2 steps

1: polyphosphoric acid

2: LiAlH₄ / diethyl ether

With lithium aluminium tetrahydride; PPA; In diethyl ether;

DOI:10.1007/BF00906359

upstream raw materials:

5-methoxy-1-indanone

5-methoxyindan-1-yl 3,5-dinitrobenzoate

3-(3-Methoxy-phenyl)-propionic acid

5-hydroxy-2,3-dihydro-1H-indene

Downstream raw materials:

C₂₁H₂₃NO

C₂₈H₂₉NO

C₂₁H₂₅NO

C₂₈H₃₁NO

Refernces

• 1、 Gui, Jiao,Xie, Haisheng,Chen, Fengjuan,Liu, Zhipeng,Zhang, Xiaoqi,Jiang, Fubin,Zeng, Wei. "Br?nsted acid/visible-light-promoted Markovnikov hydroamination of vinylarenes with arylamines". supporting information. p. 956 - 963. Retrieved 2020/02/15.
• 2、 -. "SUBSTITUTED HETEROCYCLIC DERIVATIVES AS GPR AGONISTS AND USES THEREOF". Page/Page column 130; 131. . Retrieved 2015/03/16.