3,5-Dibromo-4-oxopentanoic acid

Base Information

Chemical Name:3,5-Dibromo-4-oxopentanoic acid
CAS No.:1775-46-8
Molecular Formula:C5H6 Br2 O3
Molecular Weight:273.909
Hs Code.:2918300090
European Community (EC) Number:622-354-0
NSC Number:24873
Nikkaji Number:J82.167E
Mol file:1775-46-8.mol

Synonyms:3,5-dibromo-4-oxopentanoic acid;1775-46-8;pentanoic acid, 3,5-dibromo-4-oxo;pentanoic acid, 3,5-dibromo-4-oxo-;3,5-Dibromolaevulinic acid;NSC24873;starbld0040518;SCHEMBL2166007;NSC-24873;STL293360;AKOS016347747;PENTANOIC ACID,3,5-DIBROMO-4-OXO

Suppliers and Price of 3,5-Dibromo-4-oxopentanoic 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

Sigma-Aldrich
3,5-DIBROMOLEVULINIC ACID AldrichCPR
1g
$ 162.00

American Custom Chemicals Corporation
3,5-DIBROMOLEVULINIC ACID 95.00%
5MG
$ 498.83

Total 8 raw suppliers

Chemical Property of 3,5-Dibromo-4-oxopentanoic acid

Chemical Property:

Vapor Pressure:5.77E-06mmHg at 25°C
Melting Point:112-113 °C
Boiling Point:354.1°Cat760mmHg
PKA:3.60±0.19(Predicted)
Flash Point:167.9°C
PSA：54.37000
Density:2.114g/cm³
LogP:1.18860
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:273.86632
Heavy Atom Count:10
Complexity:146

Purity/Quality:

98%,99%, ^*data from raw suppliers

3,5-DIBROMOLEVULINIC ACID AldrichCPR ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C(C(C(=O)CBr)Br)C(=O)O

Technology Process of 3,5-Dibromo-4-oxopentanoic acid

There total 13 articles about 3,5-Dibromo-4-oxopentanoic 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: 66.0%

: 123-76-2
levulinic acid

: 1775-46-8
3,5-dibromolevulinic acid

Guidance literature:: With water; hydrogen bromide; bromine; at 0 ℃; for 4.5h;
DOI:10.1002/ejic.200600405

Reference yield:

: 123-76-2
levulinic acid

: 62557-43-1
3-bromolevulinic acid

: 1775-46-8
3,5-dibromolevulinic acid

: 3,3-Dibromo-4-oxo-pentanoic acid

: 3,5,5-tribromo-4-oxopentanoic acid

Guidance literature:: With hydrogen bromide; bromine; acetic acid; In chloroform; Further byproducts given; 1.) 50 deg C, 0.5 h, 2.) reflux, 1 h;
DOI:10.1016/S0040-4020(97)10034-5