1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane

Base Information

Chemical Name:1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane
CAS No.:212771-30-7
Molecular Formula:C15H22ClNO
Molecular Weight:267.799
Hs Code.:
DSSTox Substance ID:DTXSID90432356
Wikidata:Q72454506
Mol file:212771-30-7.mol

Synonyms:212771-30-7;1-(2-(4-(chloromethyl)phenoxy)ethyl)azepane;1-[2-[4-(chloromethyl)phenoxy]ethyl]azepane;1-{2-[4-(CHLOROMETHYL)PHENOXY]ETHYL}AZEPANE;1H-Azepine, 1-[2-[4-(chloromethyl)phenoxy]ethyl]hexahydro-;SCHEMBL1274775;DTXSID90432356;FGCIQSBZGOVNLI-UHFFFAOYSA-N;AMY32710;4-(2-azepan-1-yl-ethoxy)benzyl chloride;FT-0659157;1-[2-(4-chloromethyl-phenoxy)ethyl]-azepane;1-[2-(4-chloromethyl-phenoxy)-ethyl]-azepane;A815239;1-[2-[4-(Chloromethyl)phenoxy]ethyl]hexahydro-1H-azepine

Suppliers and Price of 1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane

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
1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97%
1g
$ 99.00

Crysdot
1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97%
5g
$ 297.00

Crysdot
1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97%
10g
$ 475.00

Chemenu
1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97%
10g
$ 449.00

Chemenu
1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97%
5g
$ 281.00

American Custom Chemicals Corporation
1-[2-(4-CHLOROMETHYL-PHENOXY)-ETHYL]AZEPANE 95.00%
1G
$ 1124.55

American Custom Chemicals Corporation
1-[2-(4-CHLOROMETHYL-PHENOXY)-ETHYL]AZEPANE 95.00%
5MG
$ 500.50

Total 22 raw suppliers

Chemical Property of 1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane

Chemical Property:

Boiling Point:392.5±27.0 °C(Predicted)
PKA:8.80±0.20(Predicted)
PSA：12.47000
Density:1.075
LogP:3.61810
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:267.1389920
Heavy Atom Count:18
Complexity:209

Purity/Quality:

98% ^*data from raw suppliers

1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCCN(CC1)CCOC2=CC=C(C=C2)CCl

Technology Process of 1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane

There total 5 articles about 1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane 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:

: 223251-16-9
[4-(2-hexamethyleneimino-1-yl-ethoxy)-phenyl]-methanol

: 212771-30-7
1-[2-(4-chloromethylphenoxy)ethyl]perhydroazepin

Guidance literature:: [4-(2-hexamethyleneimino-1-yl-ethoxy)-phenyl]-methanol; With hydrogenchloride; In tetrahydrofuran; at 0 ℃;

With thionyl chloride; In tetrahydrofuran; at 50 ℃;
DOI:10.1016/j.bmcl.2005.03.111

Reference yield:

: 123-08-0,65581-83-1
4-hydroxy-benzaldehyde

: 212771-30-7
1-[2-(4-chloromethylphenoxy)ethyl]perhydroazepin

Guidance literature:: Multi-step reaction with 4 steps

1.1: K₂CO₃ / dimethylformamide / 120 °C

2.1: NaBH₄ / methanol / 20 °C

3.1: tetrahydrofuran / Heating

4.1: HCl (gas) / tetrahydrofuran / 0 °C

4.2: SOCl₂ / tetrahydrofuran / 50 °C

With hydrogenchloride; sodium tetrahydroborate; potassium carbonate; In tetrahydrofuran; methanol; N,N-dimethyl-formamide;
DOI:10.1016/j.bmcl.2005.03.111

Reference yield:

: 52191-15-8
4-(2-bromoethyloxy)benzaldehyde

: 212771-30-7
1-[2-(4-chloromethylphenoxy)ethyl]perhydroazepin

Guidance literature:: Multi-step reaction with 3 steps

1.1: NaBH₄ / methanol / 20 °C

2.1: tetrahydrofuran / Heating

3.1: HCl (gas) / tetrahydrofuran / 0 °C

3.2: SOCl₂ / tetrahydrofuran / 50 °C

With hydrogenchloride; sodium tetrahydroborate; In tetrahydrofuran; methanol;
DOI:10.1016/j.bmcl.2005.03.111