2-Butylbenzene-1,3-dicarboxylic acid

Base Information

Chemical Name:2-Butylbenzene-1,3-dicarboxylic acid
CAS No.:5293-56-1
Molecular Formula:C12H14O4
Molecular Weight:222.241
Hs Code.:
DSSTox Substance ID:DTXSID80365124
Nikkaji Number:J1.186.881I
Wikidata:Q82149534
Mol file:5293-56-1.mol

Synonyms:2-butylbenzene-1,3-dicarboxylic acid;2-Butylisophthalic acid;5293-56-1;2-n-butylisophthalic acid;Oprea1_014577;Oprea1_712224;CBDivE_002962;SCHEMBL679426;DTXSID80365124;HMS1672A08;STL566346;AKOS000663746

Suppliers and Price of 2-Butylbenzene-1,3-dicarboxylic acid

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of 2-Butylbenzene-1,3-dicarboxylic acid

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:222.08920892
Heavy Atom Count:16
Complexity:240

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC1=C(C=CC=C1C(=O)O)C(=O)O

Technology Process of 2-Butylbenzene-1,3-dicarboxylic acid

There total 10 articles about 2-Butylbenzene-1,3-dicarboxylic 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:

: 64682-39-9
4,4,4',4'-tetramethyl-4,5,4',5'-tetrahydro-2,2'-(2-methyl-m-phenylene)-bis-oxazole

: 5293-56-1
2-n-butylisophthalic acid

Guidance literature:: Multi-step reaction with 2 steps

1: (i) nBuLi, (ii) /BRN= 505936/

2: aq. HCl

With hydrogenchloride;
DOI:10.1021/jo00398a045

Reference yield:

: 99-63-8
benzene-1,3-dicarbonyl dichloride

: 5293-56-1
2-n-butylisophthalic acid

Guidance literature:: Multi-step reaction with 4 steps

1: (i), (ii) SOCl₂

2: (i) LDA, tetra-N-methyl-ethane-1,2-diamine (ii) /BRN= 969135/

3: (i) nBuLi, (ii) /BRN= 505936/

4: aq. HCl

With hydrogenchloride;
DOI:10.1021/jo00398a045

Reference yield:

: 64682-37-7
1,3-bis(4,4-dimethyl-2-oxazoline-2-yl)benzene

: 5293-56-1
2-n-butylisophthalic acid

Guidance literature:: Multi-step reaction with 3 steps

1: (i) LDA, tetra-N-methyl-ethane-1,2-diamine (ii) /BRN= 969135/

2: (i) nBuLi, (ii) /BRN= 505936/

3: aq. HCl

With hydrogenchloride;
DOI:10.1021/jo00398a045