Khusimol

Base Information Edit

Chemical Name:Khusimol
CAS No.:16223-63-5
Molecular Formula:C₁₅H₂₄O
Molecular Weight:220.355
Hs Code.:
UNII:T4N33ECG0W
DSSTox Substance ID:DTXSID80936671
Nikkaji Number:J13.966A
Wikipedia:Khusimol
Wikidata:Q27289660
Metabolomics Workbench ID:140992
ChEMBL ID:CHEMBL511334
Mol file:16223-63-5.mol

Synonyms:khusimol

Suppliers and Price of Khusimol

Supply Marketing:Edit

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
Khusenol
10mg
$ 3025.00

TRC
Khusenol
1mg
$ 385.00

Total 15 raw suppliers

Chemical Property of Khusimol Edit

Chemical Property:

Vapor Pressure:4.4E-05mmHg at 25°C
Boiling Point:313.2°Cat760mmHg
PKA:15.00±0.10(Predicted)
Flash Point:119.7°C
PSA：20.23000
Density:1.02g/cm³
LogP:3.38740
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:220.182715385
Heavy Atom Count:16
Complexity:330

Purity/Quality:

99% ^*data from raw suppliers

Khusenol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1(C2CCC3(C2)C(CCC3C1=C)CO)C
Isomeric SMILES:CC1([C@@H]2CC[C@]3(C2)[C@H](CC[C@@H]3C1=C)CO)C
Uses Khusenol, is a component of Vetiver essential oil which is a highly esteemed basic ingredient of modern perfumery, hvaing a woody, earthy scent.

Technology Process of Khusimol

There total 9 articles about Khusimol 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:

: 18444-89-8,26410-02-6
methyl zizanoate

: 16223-63-5,52795-49-0,88034-77-9
zizanoic alcohol

Guidance literature:: With lithium aluminium tetrahydride;
DOI:10.1021/ja00770a040

Reference yield:

: 16203-25-1,19216-87-6,22387-77-5
Zizanonsaeure

: 16223-63-5,52795-49-0,88034-77-9
zizanoic alcohol

Guidance literature:: Multi-step reaction with 2 steps

2: LiAlH₄

With lithium aluminium tetrahydride;
DOI:10.1021/ja00770a040

Reference yield:

: 16203-25-1,19216-87-6,22387-77-5
(+)-zizanoic acid

: 16223-63-5,52795-49-0,88034-77-9
zizanoic alcohol

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether

2: LiAlH₄ / diethyl ether

With lithium aluminium tetrahydride; In diethyl ether;
DOI:10.1016/0040-4020(73)80044-4 DOI:10.1021/jf049182x