3-Hydroxy-6-oxoheptanenitrile

Base Information

Chemical Name:3-Hydroxy-6-oxoheptanenitrile
CAS No.:70367-36-1
Molecular Formula:C₇H₁₁NO₂
Molecular Weight:141.17
Hs Code.:
DSSTox Substance ID:DTXSID80499796
Mol file:70367-36-1.mol

Synonyms:70367-36-1;3-HYDROXY-6-OXOHEPTANENITRILE;DTXSID80499796;Heptanenitrile,3-hydroxy-6-oxo-(9ci)

Suppliers and Price of 3-Hydroxy-6-oxoheptanenitrile

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 5 raw suppliers

Chemical Property of 3-Hydroxy-6-oxoheptanenitrile

Chemical Property:

PSA：61.09000
LogP:0.63018
XLogP3:-0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:141.078978594
Heavy Atom Count:10
Complexity:156

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)CCC(CC#N)O

Technology Process of 3-Hydroxy-6-oxoheptanenitrile

There total 3 articles about 3-Hydroxy-6-oxoheptanenitrile 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: 86.0%

: 70367-30-5
4-(3-benzenesulfonyl-4,5-dihydro-isoxazol-5-yl)-butan-2-one

: 70367-36-1
3-hydroxy-6-oxoheptanenitrile

Guidance literature:: With sodium amalgam; In dichloromethane; for 2h;
DOI:10.1021/jo00390a003

Reference yield:

: 109-49-9
5-Hexen-2-one

: 70367-36-1
3-hydroxy-6-oxoheptanenitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 81 percent / aq. Na₂CO₃ / CH₂Cl₂ / 2 h

2: 86 percent / 2percent Na-Hg / CH₂Cl₂ / 2 h

With sodium amalgam; sodium carbonate; In dichloromethane;
DOI:10.1021/jo00390a003