(1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one

Base Information

Chemical Name:(1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one
CAS No.:37081-58-6
Molecular Formula:C9H12O2
Molecular Weight:152.193
Hs Code.:
DSSTox Substance ID:DTXSID10373070
Nikkaji Number:J469.713H
Mol file:37081-58-6.mol

Synonyms:(1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one;37081-58-6;SCHEMBL19251729;DTXSID10373070;AKOS004909845;(3beta,6beta)-2alpha,7alpha-Dimethyl-3,6-epoxy-4-cycloheptene-1-one

Suppliers and Price of (1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one

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

Crysdot
(1R,2S,4R,5S)-2,4-Dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one 95+%
1g
$ 772.00

Chemenu
(1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one 95%
1g
$ 729.00

American Custom Chemicals Corporation
(1R,2S,4R,5S)-2,4-DIMETHYL-8-OXABICYCLO[3.2.1]OCT-6-EN-3-ONE 95.00%
1G
$ 1575.00

American Custom Chemicals Corporation
(1R,2S,4R,5S)-2,4-DIMETHYL-8-OXABICYCLO[3.2.1]OCT-6-EN-3-ONE 95.00%
5MG
$ 497.76

Alichem
(1R,2S,4R,5S)-2,4-Dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one
1g
$ 653.12

Total 3 raw suppliers

Chemical Property of (1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one

Chemical Property:

PSA：26.30000
LogP:1.16490
Storage Temp.:2-8°C
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:152.083729621
Heavy Atom Count:11
Complexity:200

Purity/Quality:

≥99% ^*data from raw suppliers

(1R,2S,4R,5S)-2,4-Dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1C2C=CC(O2)C(C1=O)C
Isomeric SMILES:C[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H](C1=O)C

Technology Process of (1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one

There total 2 articles about (1R,2S,4R,5S)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one 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: 32.0%

: 110-00-9
furan

: 67-56-1
methanol

: 998-40-3
tributylphosphine

: trans-2,4-Dimethyl-3-thietanon

: 53475-16-4
2-methylsulfanyl-pentan-3-one

: 814-29-9
Tributylphosphine oxide

: 3084-50-2
tri-n-butylphosphine sulfide

: 37081-58-6
(1R,2S,4R,5S)-2,4-dimethyl-8-oxa-bicyclo[3.2.1]oct-6-en-3-one

Guidance literature:: for 48h; Product distribution; Ambient temperature;

Reference yield:

: 110-00-9
furan

: 67-56-1
methanol

: 603-35-0
triphenylphosphine

: trans-2,4-Dimethyl-3-thietanon

: 53475-16-4
2-methylsulfanyl-pentan-3-one

: 17042-18-1
2-methoxy-3-pentanone

: 37081-58-6
(1R,2S,4R,5S)-2,4-dimethyl-8-oxa-bicyclo[3.2.1]oct-6-en-3-one

: 3878-45-3
triphenylphosphine sulfide

: 791-28-6
Triphenylphosphine oxide

Guidance literature:: for 150h; Mechanism; Product distribution; Ambient temperature;

Reference yield: 83.0%

: 26164-26-1
(S)-2-methoxy-2-phenylacetic acid

: 37081-58-6
(1R,2S,4R,5S)-2,4-dimethyl-8-oxa-bicyclo[3.2.1]oct-6-en-3-one

: 401911-88-4
(S)-Methoxy-phenyl-acetic acid (1R,5R,7S)-5,7-dimethyl-6-oxo-cyclohept-2-enyl ester

: (S)-Methoxy-phenyl-acetic acid (1S,5S,7R)-5,7-dimethyl-6-oxo-cyclohept-2-enyl ester

Guidance literature:: (1R,2S,4R,5S)-2,4-dimethyl-8-oxa-bicyclo[3.2.1]oct-6-en-3-one; With lithium [R(R*,R*)]-(+)-bis(α-methylbenzyl)amide; tert-butyldimethylsilyl chloride; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; at -78 ℃; for 24h;

With lithium perchlorate; diisobutylaluminium hydride; In toluene; at 0 - 20 ℃;

(S)-2-methoxy-2-phenylacetic acid; With dmap; dicyclohexyl-carbodiimide; In dichloromethane; at 0 ℃;
DOI:10.1021/ol010253c