(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)

Base Information

Chemical Name:(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)
CAS No.:160191-64-0
Molecular Formula:C25H30N2O2
Molecular Weight:390.525
Hs Code.:29349990
European Community (EC) Number:691-519-7
DSSTox Substance ID:DTXSID40449873
Nikkaji Number:J608.515F
Wikidata:Q76416326
Mol file:160191-64-0.mol

Synonyms:160191-64-0;(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole);(4S,4'S)-2,2'-(Pentane-3,3-diyl)bis(4-benzyl-4,5-dihydrooxazole);(4S)-4-benzyl-2-[3-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]pentan-3-yl]-4,5-dihydro-1,3-oxazole;(S,S)-3,3-Bis(4-benzyl-2-oxazolin-2-yl)pentane;Bnbox;(4S)-4-BENZYL-2-{3-[(4S)-4-BENZYL-4,5-DIHYDRO-1,3-OXAZOL-2-YL]PENTAN-3-YL}-4,5-DIHYDRO-1,3-OXAZOLE;SCHEMBL13727286;(S,S)-2,2'-(Diethylmethylene)bis(4-benzyl-2-oxazoline);DTXSID40449873;MFCD20265601;CS-W009734;Oxazole, 2,2'-(1-ethylpropylidene)bis[4,5-dihydro-4-(phenylmethyl)-, (4S,4'S)-;AS-73548;P1947;T71869;A906588;(4S,4/'S)-2,2/'-(Pentane-3,3/'-diyl)bis(4-benzyl-4,5-dihydrooxazole)

Suppliers and Price of (4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)

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

TRC
(4S,4''S)-2,2''-(Pentane-3,3''-diyl)bis(4-benzyl-4,5-dihydrooxazole)
5mg
$ 60.00

TRC
(4S,4''S)-2,2''-(Pentane-3,3''-diyl)bis(4-benzyl-4,5-dihydrooxazole)
2.5mg
$ 45.00

TRC
(4S,4''S)-2,2''-(Pentane-3,3''-diyl)bis(4-benzyl-4,5-dihydrooxazole)
25mg
$ 75.00

TCI Chemical
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole) >98.0%(T)
200mg
$ 144.00

TCI Chemical
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole) >98.0%(T)
1g
$ 501.00

Frontier Specialty Chemicals
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole) 98%
500mg
$ 484.00

Frontier Specialty Chemicals
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole) 98%
100mg
$ 107.00

Chem-Impex
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole),98%(Assaybytitration) 98%(Assaybytitration)
1G
$ 538.72

Chem-Impex
(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole),98%(Assaybytitration) 98%(Assaybytitration)
200MG
$ 141.12

Ambeed
(4S,4'S)-2,2'-(pentane-3,3-diyl)bis(4-benzyl-4,5-dihydrooxazole) 98%
100mg
$ 65.00

Total 9 raw suppliers

Chemical Property of (4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)

Chemical Property:

Boiling Point:506.6±33.0 °C(Predicted)
PKA:5.57±0.70(Predicted)
PSA：43.18000
Density:1.12±0.1 g/cm3(Predicted)
LogP:3.74400
XLogP3:5.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:390.230728204
Heavy Atom Count:29
Complexity:536

Purity/Quality:

97% ^*data from raw suppliers

(4S,4''S)-2,2''-(Pentane-3,3''-diyl)bis(4-benzyl-4,5-dihydrooxazole) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/38
Safety Statements: 6-26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(CC)(C1=NC(CO1)CC2=CC=CC=C2)C3=NC(CO3)CC4=CC=CC=C4
Isomeric SMILES:CCC(CC)(C1=N[C@H](CO1)CC2=CC=CC=C2)C3=N[C@H](CO3)CC4=CC=CC=C4
Uses (4S,4''S)-2,2''-(Pentane-3,3''-diyl)bis(4-benzyl-4,5-dihydrooxazole) is a chemical compound used in the preparation and synthesis of chiral bis(oxalozidinones).

Technology Process of (4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)

There total 12 articles about (4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole) 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%

: 132098-58-9,1646862-39-6
2,2'-methylenebis[(4S)-4-benzyl-4,5-dihydro-2-oxazole]

: 75-03-6
ethyl iodide

: 160191-64-0,1192345-90-6
(4S)-2,2'-(1-Ethylpropylidene)bis<4-(1-phenylethyl)-4,5-dihydrooxazole>

Guidance literature:: 2,2'-methylenebis[(4S)-4-benzyl-4,5-dihydro-2-oxazole]; With sodium hydride; In tetrahydrofuran; at -5 - 20 ℃; for 2h; Inert atmosphere;

ethyl iodide; In tetrahydrofuran; at 20 ℃; for 24h; Inert atmosphere;

Reference yield:

: 169769-02-2
N,N'-Bis<(1S)-2-hydroxy-1-(phenylmethyl)ethyl>-2,2-diethyl-1,3-propanediamide

: 160191-64-0,1192345-90-6
(4S)-2,2'-(1-Ethylpropylidene)bis<4-(1-phenylethyl)-4,5-dihydrooxazole>

Guidance literature:: With sodium hydroxide; methanesulfonyl chloride; triethylamine; Yield given. Multistep reaction; 1.) CH₂Cl₂, MeOH, 2.) H₂O, reflux.;
DOI:10.1021/jo9702397

Reference yield:

: 3182-95-4
L-Phenylalaninol

: 160191-64-0,1192345-90-6
(4S)-2,2'-(1-Ethylpropylidene)bis<4-(1-phenylethyl)-4,5-dihydrooxazole>

Guidance literature:: Multi-step reaction with 2 steps

1: 98 percent / Et₃N / CH₂Cl₂ / 12 h / Ambient temperature

2: 1.) MsCl, Et₃N, 2.) NaOH / 1.) CH₂Cl₂, MeOH, 2.) H₂O, reflux.

With sodium hydroxide; methanesulfonyl chloride; triethylamine; In dichloromethane;
DOI:10.1021/jo9702397