Isobenzofuran, 1-butyl-1,3-dihydro-

Base Information

Chemical Name:Isobenzofuran, 1-butyl-1,3-dihydro-
CAS No.:180068-03-5
Molecular Formula:C12H16O
Molecular Weight:176.258
Hs Code.:
DSSTox Substance ID:DTXSID80442681
Nikkaji Number:J763.036K

Synonyms:180068-03-5;1-butyl-1,3-dihydroisobenzofuran;Isobenzofuran, 1-butyl-1,3-dihydro-;1-Butylphthalan;SCHEMBL1702059;DTXSID80442681

Suppliers and Price of Isobenzofuran, 1-butyl-1,3-dihydro-

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of Isobenzofuran, 1-butyl-1,3-dihydro-

Chemical Property:

PSA：9.23000
LogP:3.44810
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:176.120115130
Heavy Atom Count:13
Complexity:155

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC1C2=CC=CC=C2CO1

Technology Process of Isobenzofuran, 1-butyl-1,3-dihydro-

There total 1 articles about Isobenzofuran, 1-butyl-1,3-dihydro- 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:

: 1-Butyl-1,3-dihydro-isobenzofuran-1-ol

: 180068-03-5
n-butyl phthalan

: 5-(2'-hydroxymethylphenyl)-4-nonene

: 2,2-dibutylphthalan

Guidance literature:: With triethylsilane; boron trifluoride diethyl etherate; In dichloromethane; Yield given; -45 deg C to rt;
DOI:10.3987/COM-97-8060

Reference yield: 35.0%

: 180068-03-5
n-butyl phthalan

: 3413-15-8,6066-49-5,93133-67-6,125412-70-6
butylphthalide

Guidance literature:: With 5-methyl-2-furanone; dmap; oxygen; In toluene; at 100 ℃; for 48h; Inert atmosphere;
DOI:10.1039/d0ob00729c

Reference yield:

: 180068-03-5
n-butyl phthalan

: 73178-44-6
1-(2-methylphenyl)-1-pentanol

: 110683-66-4
o-amylbenzyl alcohol

Guidance literature:: With naphthalene; water; lithium; Yield given. Multistep reaction. Yields of byproduct given; 1) THF, 0 deg C, 5 h;
DOI:10.1021/jo9604548