N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane

Base Information

Chemical Name:N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane
CAS No.:53719-89-4
Molecular Formula:C10H16Cl2N2O2
Molecular Weight:267.155
Hs Code.:
DSSTox Substance ID:DTXSID70435007
Nikkaji Number:J1.580.171I
Wikidata:Q82249663

Synonyms:53719-89-4;N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane;SCHEMBL6155876;DTXSID70435007;NXWRKAARNQHEEG-HTQZYQBOSA-N;trans-1,2-Bis(chloroacetamido)cyclohexane;N,N'-[(1R)-Cyclohexane-1beta,2alpha-diyl]bis(2-chloroacetamide)

Suppliers and Price of N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane

Chemical Property:

XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:266.0588831
Heavy Atom Count:16
Complexity:235

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(C(C1)NC(=O)CCl)NC(=O)CCl
Isomeric SMILES:C1CC[C@H]([C@@H](C1)NC(=O)CCl)NC(=O)CCl

Technology Process of N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane

There total 3 articles about N,N'-bis(chloroacetyl)-trans-1,2-diaminocyclohexane 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: 95.0%

: 79-04-9
chloroacetyl chloride

: 32044-22-7,39961-95-0
(1R,2R)-1,2-diaminocyclohexane tartrate

: 53719-89-4
(R,R)-2-chloro-N-[2-(2-chloro-acetylamino)cyclohexyl]acetamide

Guidance literature:: With triethylamine; In dichloromethane; at 20 ℃; for 30h;
DOI:10.1016/S0957-4166(01)00198-7

Reference yield: 84.4%

: 20439-47-8
(1R,2R)-1,2-diaminocyclohexane

: 79-04-9
chloroacetyl chloride

: 53719-89-4
(R,R)-2-chloro-N-[2-(2-chloro-acetylamino)cyclohexyl]acetamide

Guidance literature:: With potassium carbonate; In chloroform; water; 1.) -3 to 3 deg C, 1 h 20 min, 2.) -3 deg C to room temp., 2 h 20 min;
DOI:10.1021/ja964271e