(Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine

Base Information

Chemical Name:(Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine
CAS No.:157698-32-3
Molecular Formula:C₂₆H₂₉NO
Molecular Weight:376.483
Hs Code.:
Nikkaji Number:J595.221B
Mol file:157698-32-3.mol

Synonyms:Tamoxifen-d5;157698-32-3;Tamoxifen-?d5;Tamoxifen-ethyl-d5;(Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine;N,N-dimethyl-2-[4-[(Z)-3,3,4,4,4-pentadeuterio-1,2-diphenylbut-1-enyl]phenoxy]ethanamine;Ethanamine, 2-(4-(1,2-diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethyl-, (Z)-;(E/Z)-Tamoxifen-d5;C26H24D5NO;C26-H24-D5-N-O;HY-13757AS;AKOS040739817;(Z)-1-[4-[2-(Dimethylamino)ethoxy]phenyl]-1,2-diphenyl-1-butene-3,3,4,4,4-d5;MS-26118;CS-0109153;J-009441

Suppliers and Price of (Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine

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

Usbiological
Tamoxifen-ethyl-d5
1mg
$ 425.00

TRC
Tamoxifen-d5
1mg
$ 155.00

Cayman Chemical
Tamoxifen-d5 ≥99%
1mg
$ 124.00

Cayman Chemical
Tamoxifen-d5 ≥99%
500μg
$ 69.00

American Custom Chemicals Corporation
TAMOXIFEN-D5 (ETHYL-D5) 95.00%
5MG
$ 503.14

AK Scientific
(Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine
1mg
$ 267.00

Total 4 raw suppliers

Chemical Property of (Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine

Chemical Property:

Vapor Pressure:1.85E-09mmHg at 25°C
Melting Point:95-97°C
Boiling Point:482.3°Cat760mmHg
Flash Point:140°C
PSA：12.47000
Density:1.057g/cm³
LogP:5.99610
XLogP3:7.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:376.256298278
Heavy Atom Count:28
Complexity:463

Purity/Quality:

97% ^*data from raw suppliers

Tamoxifen-ethyl-d5 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3
Isomeric SMILES:[2H]C([2H])([2H])C([2H])([2H])/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3
Uses A labelled, nonsteroidal estrogen antagonist of interest in the treatment of some forms of breast cancer Labelled Tamoxifen (T006000). A nonsteroidal estrogen antagonist of interest in the treatment of some forms of breast cancer. Tamoxifen is a protein kinase C inhibitor, and induces apoptosis in human malignant glioma cell lines.

Technology Process of (Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine

There total 6 articles about (Z)-2-(4-(1,2-Diphenyl-1-butenyl-3,3,4,4,4-d5)phenoxy)-N,N-dimethylethanamine 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: 89.0%

: 124-40-3
dimethyl amine

: 157738-49-3
<3,3,4,4,4-2H5>-(Z)-1-<4-(2-chloroethoxy)phenyl>-1,2-diphenyl-1-butene

: 157698-32-3
-tamoxifen

Guidance literature:: In ethanol; at 80 ℃; for 16h;
DOI:10.1002/jlcr.2580340810

Reference yield:

: 103-82-2
phenylacetic acid

: 157698-32-3
-tamoxifen

Guidance literature:: Multi-step reaction with 5 steps

1: 53 percent / trifluoroacetic anhydride / 24 h / Ambient temperature

2: 1.) NaH / 1.) THF, 30 min, 2.) THF, RT, 3 h

3: tetrahydrofuran; hexane / -78 - 20 °C

4: HCl, EtOH / 3 h / Heating

5: 89 percent / ethanol / 16 h / 80 °C

With hydrogenchloride; ethanol; sodium hydride; trifluoroacetic anhydride; In tetrahydrofuran; ethanol; hexane;
DOI:10.1002/jlcr.2580340810

Reference yield:

: 19561-95-6
1-<4-(2-chloroethoxy)phenyl>-2-phenylethanone

: 157698-32-3
-tamoxifen

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) NaH / 1.) THF, 30 min, 2.) THF, RT, 3 h

2: tetrahydrofuran; hexane / -78 - 20 °C

3: HCl, EtOH / 3 h / Heating

4: 89 percent / ethanol / 16 h / 80 °C

With hydrogenchloride; ethanol; sodium hydride; In tetrahydrofuran; ethanol; hexane;
DOI:10.1002/jlcr.2580340810