6-HYDROXYCAPROIC ACID

Base Information

Chemical Name:6-HYDROXYCAPROIC ACID
CAS No.:1191-25-9
Molecular Formula:C6H12O3
Molecular Weight:132.159
Hs Code.:29181998
European Community (EC) Number:681-173-5
NSC Number:617319
UNII:3Y3OX37NM8
DSSTox Substance ID:DTXSID00152316
Nikkaji Number:J262.001D
Wikidata:Q27102678
Metabolomics Workbench ID:1292
ChEMBL ID:CHEMBL2006530
Mol file:1191-25-9.mol

Synonyms:6-Hydroxycaproicacid;6-Hydroxyhexanoic acid;NSC 617319;e-Hydroxycaproic acid;

Suppliers and Price of 6-HYDROXYCAPROIC 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

Usbiological
6-Hydroxyhexanoic acid
5g
$ 729.00

Matrix Scientific
6-Hydroxycaproic acid 97%
1g
$ 62.00

Matrix Scientific
6-Hydroxycaproic acid 97%
500mg
$ 41.00

Crysdot
6-Hydroxyhexanoicacid 95+%
25g
$ 1003.00

Crysdot
6-Hydroxyhexanoicacid 94%
25g
$ 1001.00

Crysdot
6-Hydroxyhexanoicacid 94%
10g
$ 475.00

Crysdot
6-Hydroxyhexanoicacid 95+%
10g
$ 475.00

Crysdot
6-Hydroxyhexanoicacid 94%
5g
$ 248.00

Crysdot
6-Hydroxyhexanoicacid 95+%
5g
$ 248.00

Crysdot
6-Hydroxyhexanoicacid 95+%
1g
$ 67.00

Total 90 raw suppliers

Chemical Property of 6-HYDROXYCAPROIC ACID

Chemical Property:

Appearance/Colour:white low melting crystalline solid
Vapor Pressure:0.00078mmHg at 25°C
Melting Point:38-40 °C
Refractive Index:1.44
Boiling Point:272.6 °C at 760 mmHg
PKA:4.75±0.10(Predicted)
Flash Point:132.9 °C
PSA：57.53000
Density:1.104 g/cm³
LogP:0.62370
Storage Temp.:Freezer (-20°C)
Water Solubility.:Soluble in water.
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:132.078644241
Heavy Atom Count:9
Complexity:80.4

Purity/Quality:

99%, ^*data from raw suppliers

6-Hydroxyhexanoic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): C
Hazard Codes:C
Statements: 34
Safety Statements: 24/25-45-36/37/39-26-23

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(CCC(=O)O)CCO
Uses 6-Hydroxyhexanoic acid acts as a useful reagent in synthetic chemistry. It is used as a precursor to prepare surface active monomers.

Technology Process of 6-HYDROXYCAPROIC ACID

There total 84 articles about 6-HYDROXYCAPROIC 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: 85.4%

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 502-44-3,24980-41-4,80137-66-2
hexahydro-2H-oxepin-2-one

: 1191-25-9
6-Hydroxyhexanoic acid

Guidance literature:: With dihydrogen peroxide; acetic acid; In water; at 70 ℃; for 1h; Reagent/catalyst;

Reference yield: 61.0%

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 100-52-7
benzaldehyde

: 502-44-3,24980-41-4,80137-66-2
hexahydro-2H-oxepin-2-one

: 1191-25-9
6-Hydroxyhexanoic acid

: 65-85-0,8013-63-6
benzoic acid

Guidance literature:: With oxygen; In benzene; at 25 ℃; for 8h;
DOI:10.1016/j.crci.2010.01.007

Reference yield: 44.0%

: 592-90-5
oxepane

: 502-44-3,24980-41-4,80137-66-2
hexahydro-2H-oxepin-2-one

: 124-04-9
Adipic acid

: 1191-25-9
6-Hydroxyhexanoic acid

Guidance literature:: With 2,6-dichloropyridine N-oxide; dichloro(5,10,15,20-tetramesitylporphyrinato)ruthenium(IV); In 1,2-dichloro-ethane; at 40 ℃; for 20h; Inert atmosphere;
DOI:10.1142/S1088424615500297