3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione

Base Information

Chemical Name:3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione
CAS No.:21647-15-4
Molecular Formula:C12H20 N2 O2
Molecular Weight:224.2994
Hs Code.:
NSC Number:157453
DSSTox Substance ID:DTXSID10303231
Wikidata:Q82048399
ChEMBL ID:CHEMBL3218325
Mol file:21647-15-4.mol

Synonyms:21647-15-4;3,4-bis(butylamino)cyclobut-3-ene-1,2-dione;NSC157453;CHEMBL3218325;DTXSID10303231;AKOS024339761;NSC-157453;3,4-BIS(BUTYLAMINO)-3-CYCLOBUTENE-1,2-DIONE

Suppliers and Price of 3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione

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 3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione

Chemical Property:

Vapor Pressure:0.00023mmHg at 25°C
Boiling Point:325.5°Cat760mmHg
Flash Point:116.6°C
Density:1.06g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:224.152477885
Heavy Atom Count:16
Complexity:278

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCNC1=C(C(=O)C1=O)NCCCC

Technology Process of 3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione

There total 2 articles about 3,4-Bis(butylamino)cyclobut-3-ene-1,2-dione 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: 34.0%

: 2892-62-8
3,4-dibutoxy-3-cyclobutene-1,2-dione

: 109-73-9,85404-21-3
N-butylamine

: 21647-15-4
3,4-bis-(Butylamino)cyclobutene-1,2-dione

Guidance literature:: for 1h; Heating;

Reference yield:

: 109-73-9,85404-21-3
N-butylamine

: 5231-87-8
3,4-diethoxy-3-cyclobuten-1,2-dione

: 21647-15-4
3,4-bis-(Butylamino)cyclobutene-1,2-dione

Guidance literature:

Reference yield:

: 931-53-3
Cyclohexyl isocyanide

: 555-16-8
4-nitrobenzaldehdye

: 21647-15-4
3,4-bis-(Butylamino)cyclobutene-1,2-dione

: 62-53-3
aniline

: C₄₄H₄₄N₆O₈

: C₄₄H₄₄N₆O₈

Guidance literature:: 4-nitrobenzaldehdye; aniline; In methanol; at 20 ℃; for 0.75h;

3,4-bis-(Butylamino)cyclobutene-1,2-dione; In methanol; at 20 ℃; for 0.166667h;

Cyclohexyl isocyanide; In methanol; at 20 ℃; Overall yield = 80 %;
DOI:10.3184/174751915X14266899341593