4-Hydroxybutyl butanoate

Base Information

Chemical Name:4-Hydroxybutyl butanoate
CAS No.:55011-60-4
Molecular Formula:C8H16O3
Molecular Weight:160.21
Hs Code.:2915600000
DSSTox Substance ID:DTXSID10597471
Wikidata:Q82493020
Mol file:55011-60-4.mol

Synonyms:4-hydroxybutyl butanoate;55011-60-4;4-hydroxybutyl butyrate;1,4-butandiol monobutyrate;DIETHYLNONYLMALONATE;SCHEMBL2527254;DTXSID10597471;HKHMPQJGZDCJAG-UHFFFAOYSA-N;MFCD18157659;BUTANOICACID4-HYDROXYBUTYLESTER;AKOS015839535;LE-0059;SB84368;(r)-3-hydroxy-2-methyl propyl butyrate;DB-297083;J-515516

Suppliers and Price of 4-Hydroxybutyl butanoate

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
4-HydroxybutylButanoate
100mg
$ 60.00

Matrix Scientific
4-Hydroxybutyl butanoate >95%
1g
$ 246.00

Matrix Scientific
4-Hydroxybutyl butanoate >95%
500mg
$ 192.00

Matrix Scientific
4-Hydroxybutyl butanoate >95%
5g
$ 565.00

American Custom Chemicals Corporation
4-HYDROXYBUTYL BUTANOATE 98.00%
1G
$ 722.80

American Custom Chemicals Corporation
4-HYDROXYBUTYL BUTANOATE 98.00%
2.5L
$ 6614.30

American Custom Chemicals Corporation
4-HYDROXYBUTYL BUTANOATE 98.00%
10G
$ 1585.35

American Custom Chemicals Corporation
4-HYDROXYBUTYL BUTANOATE 98.00%
5G
$ 1115.96

AK Scientific
4-Hydroxybutylbutanoate
5g
$ 812.00

AK Scientific
4-Hydroxybutylbutanoate
500mg
$ 309.00

Total 9 raw suppliers

Chemical Property of 4-Hydroxybutyl butanoate

Chemical Property:

PSA：46.53000
LogP:1.10220
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:160.109944368
Heavy Atom Count:11
Complexity:102

Purity/Quality:

98%min ^*data from raw suppliers

4-HydroxybutylButanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC(=O)OCCCCO

Technology Process of 4-Hydroxybutyl butanoate

There total 5 articles about 4-Hydroxybutyl butanoate 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: 78.0%

: 110-63-4
Butane-1,4-diol

: 107-92-6
butyric acid

: 55011-60-4
1,4-butandiol monobutyrate

Guidance literature:: toluene-4-sulfonic acid; In octane; for 1h; Heating / reflux;

Reference yield:

: 2051-78-7
allyl butyrate

: 201230-82-2
carbon monoxide

: 55011-60-4
1,4-butandiol monobutyrate

: C₈H₁₆O₃

Guidance literature:: allyl butyrate; carbon monoxide; With dicobalt octacarbonyl; C₂₀H₃₉P; hydrogen; sodium acetate; In toluene; at 110 ℃; for 22h; under 31029.7 Torr; Autoclave;

With sodium tetrahydroborate; In methanol; toluene; at 0 ℃; for 1h; Overall yield = 55 %; regioselective reaction;
DOI:10.1016/j.tet.2015.01.006