3,5-Diethynylbenzoic acid

Base Information

Chemical Name:3,5-Diethynylbenzoic acid
CAS No.:883106-26-1
Molecular Formula:C11H6 O2
Molecular Weight:170.167
Hs Code.:2916399090
DSSTox Substance ID:DTXSID10476232
Nikkaji Number:J3.108.851H
Mol file:883106-26-1.mol

Synonyms:3,5-Diethynylbenzoic acid;883106-26-1;3,5-DIETHYNYL-BENZOIC ACID;3,5-Diethynylbenzoicacid;Benzoic acid, 3,5-diethynyl-;C11H6O2;3,5-DIETHYNYL-BENZOICACID;SCHEMBL689840;AMY1102;DTXSID10476232;MFCD06658429;AKOS006227700;DS-7858;CS-0158571;FT-0692002;C76912;A922674

Suppliers and Price of 3,5-Diethynylbenzoic 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

TRC
3,5-DiethynylbenzoicAcid
50mg
$ 155.00

Synthonix
3,5-Diethynylbenzoicacid 95+%
5g
$ 3140.00

Synthonix
3,5-Diethynylbenzoicacid 95+%
1g
$ 690.00

Synthonix
3,5-Diethynylbenzoicacid 95+%
250mg
$ 220.00

Synthonix
3,5-Diethynylbenzoicacid 95+%
100mg
$ 110.00

SynQuest Laboratories
3,5-Diethynylbenzoic acid
250 mg
$ 352.00

SynQuest Laboratories
3,5-Diethynylbenzoic acid
1 g
$ 888.00

Labseeker
3,5-diethynylbenzoicacid 95
1kg
$ 8166.00

Crysdot
3,5-Diethynylbenzoicacid 95+%
5g
$ 1664.00

American Custom Chemicals Corporation
3,5-DI ETHYNYL BENZOIC ACID 95.00%
5MG
$ 496.18

Total 41 raw suppliers

Chemical Property of 3,5-Diethynylbenzoic acid

Chemical Property:

Boiling Point:355.0±37.0 °C(Predicted)
PKA:3.78±0.10(Predicted)
PSA：37.30000
Density:1.25±0.1 g/cm3(Predicted)
LogP:1.34740
Storage Temp.:2-8°C
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:170.036779430
Heavy Atom Count:13
Complexity:275

Purity/Quality:

97% ^*data from raw suppliers

3,5-DiethynylbenzoicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C#CC1=CC(=CC(=C1)C(=O)O)C#C

Technology Process of 3,5-Diethynylbenzoic acid

There total 9 articles about 3,5-Diethynylbenzoic 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: 88.0%