Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride

Base Information

Chemical Name:Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride
CAS No.:78431-97-7
Molecular Formula:C₁₁H₁₉Cl₂NO₂*ClH
Molecular Weight:304.644
Hs Code.:
NSC Number:297906
DSSTox Substance ID:DTXSID30147452

Synonyms:105971-55-9;NSC 297906;Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride;4-(Bis(2-chloroethyl)amino)cyclohexanecarboxylic acid hydrochloride;C11H19Cl2NO2.ClH;DTXSID30147452;NSC297906;WLN: L6TJ AVQ DN2G2G &GH;C11-H19-Cl2-N-O2.Cl-H;NSC-297906;LS-56620;78431-97-7

Suppliers and Price of Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride

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

Total 4 raw suppliers

Chemical Property of Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride

Chemical Property:

Vapor Pressure:1.38E-05mmHg at 25°C
Boiling Point:342.2°Cat760mmHg
Flash Point:160.8°C
Density:1.23g/cm³
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:303.055962
Heavy Atom Count:17
Complexity:212

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(CCC1C(=O)O)N(CCCl)CCCl.Cl

Technology Process of Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride

There total 3 articles about Cyclohexanecarboxylic acid, 4-(bis(2-chloroethyl)amino)-, hydrochloride 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%

: 78431-94-4
4-[Bis-(2-chloro-ethyl)-amino]-cyclohexanecarboxylic acid ethyl ester; hydrochloride

: 78431-97-7
4-[Bis-(2-chloro-ethyl)-amino]-cyclohexanecarboxylic acid; hydrochloride

Guidance literature:: With hydrogenchloride; for 1.5h; Heating;
DOI:10.1007/BF00962271

Reference yield:

: 1678-68-8,3685-28-7,51498-33-0
cis-4-amino-cyclohexanecarboxylic acid ethyl ester

: 78431-97-7
4-[Bis-(2-chloro-ethyl)-amino]-cyclohexanecarboxylic acid; hydrochloride

Guidance literature:: Multi-step reaction with 3 steps

1: 52 percent / H₂O

2: 44 percent / SOCl₂ / CHCl₃ / 1 h / 20 °C

3: 89 percent / aq. HCl / 1.5 h / Heating

With hydrogenchloride; thionyl chloride; In chloroform; water;
DOI:10.1007/BF00962271

Reference yield:

: 78431-91-1
4-[Bis-(2-hydroxy-ethyl)-amino]-cyclohexanecarboxylic acid ethyl ester

: 78431-97-7
4-[Bis-(2-chloro-ethyl)-amino]-cyclohexanecarboxylic acid; hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 44 percent / SOCl₂ / CHCl₃ / 1 h / 20 °C

2: 89 percent / aq. HCl / 1.5 h / Heating

With hydrogenchloride; thionyl chloride; In chloroform;
DOI:10.1007/BF00962271