(Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid

Base Information

Chemical Name:(Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid
CAS No.:104693-32-5
Molecular Formula:C₁₉H₂₆O₄
Molecular Weight:318.413
Hs Code.:2932999099
ChEMBL ID:CHEMBL345614
Mol file:104693-32-5.mol

Synonyms:7-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)heptenoic acid;7-DDPDHA

Suppliers and Price of (Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemicals and raw materials
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Total 1 raw suppliers

Chemical Property of (Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid

Chemical Property:

Vapor Pressure:1.96E-09mmHg at 25°C
Boiling Point:464.7°Cat760mmHg
Flash Point:161°C
PSA：55.76000
Density:1.063g/cm³
LogP:4.32800
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:318.18310931
Heavy Atom Count:23
Complexity:396

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(OCC(C(O1)C2=CC=CC=C2)CC=CCCCC(=O)O)C
Isomeric SMILES:CC1(OC[C@H]([C@H](O1)C2=CC=CC=C2)C/C=C\CCCC(=O)O)C

Technology Process of (Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid

There total 2 articles about (Z)-7-[(4S,5R)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic 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:

: 104693-37-0
(4,5-cis)-5-allyl-2,2-dimethyl-4-phenyl-1,3-dioxane

: 104693-32-5
(5Z)-7-(2,2-dimethyl-4-phenyl-1,3-dioxan-cis-5-yl)heptenoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) ozone, 2.) Ph₃P / 1.) CH₂Cl₂, -78 deg C, 2.) CH₂Cl₂, 25 deg C

2: 1.) t-BuOK / 1.) THF, 0 deg C, 1 h, 2.) THF, 3 h

With potassium tert-butylate; ozone; triphenylphosphine;
DOI:10.1021/jm00384a012

Reference yield:

: 17814-85-6
(4-carboxybutyl)triphenylphosphonium bromide

: 104693-39-2
(2,2-dimethyl-4-phenyl-1,3-dioxan-cis-5-yl)acetaldehyde

: 104693-32-5
(5Z)-7-(2,2-dimethyl-4-phenyl-1,3-dioxan-cis-5-yl)heptenoic acid

Guidance literature:: With potassium tert-butylate; Yield given. Multistep reaction; 1.) THF, 0 deg C, 1 h, 2.) THF, 3 h;
DOI:10.1021/jm00384a012