3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid

Base Information

Chemical Name:3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid
CAS No.:5604-83-1
Molecular Formula:C₁₅H₂₂O₄
Molecular Weight:266.337
Hs Code.:
DSSTox Substance ID:DTXSID30971416
Wikidata:Q82954916

Synonyms:3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid;130373-81-8;3-(1,3-dihydro-2H-isoindol-2-yl)benzoic acid;3-(Isoindolin-2-yl)benzoic acid;3-(1,3-dihydroisoindol-2-yl)benzoic acid;5604-83-1;CBMicro_025887;Oprea1_089716;DTXSID30971416;CCG-12745;MFCD00755025;STK114151;AKOS000300700;SB64706;BS-35661;BIM-0025650.P001;FT-0718733;SR-01000505791;SR-01000505791-1

Suppliers and Price of 3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid

Chemical Property:

Vapor Pressure:1.58E-09mmHg at 25°C
Refractive Index:1.659
Boiling Point:467.2°Cat760mmHg
PKA:11.37±0.46(Predicted)
Flash Point:236.3°C
PSA：40.54000
Density:1.284g/cm³
LogP:2.97000
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:239.094628657
Heavy Atom Count:18
Complexity:304

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C2=CC=CC=C2CN1C3=CC=CC(=C3)C(=O)O

Technology Process of 3-(1,3-Dihydro-isoindol-2-yl)-benzoic acid

There total 3 articles about 3-(1,3-Dihydro-isoindol-2-yl)-benzoic 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:

: 7560-68-1
Ethinyl-<4-methyl-cyclohexen-(3)-yl>-carbinol

: 5604-83-1
Malonic acid ethyl ester 1-(4-methyl-cyclohex-3-enyl)-allyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 170 - 175 °C

2: H₂ / Lindlar catalyst

With hydrogen; Lindlar's catalyst;
DOI:10.1007/BF00856052

Reference yield:

: 105-53-3
diethyl malonate

: 5604-83-1
Malonic acid ethyl ester 1-(4-methyl-cyclohex-3-enyl)-allyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 170 - 175 °C

2: H₂ / Lindlar catalyst

With hydrogen; Lindlar's catalyst;
DOI:10.1007/BF00856052