CAS 13681-87-3 | DIETHYLDITHIOCARBAMIC ACID COPPER SALT | CAS Number 13681-87-3

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13681-87-3 | DIETHYLDITHIOCARBAMIC ACID COPPER SALT

CAS No: 13681-87-3 Catalog No: AG003PHX MDL No:MFCD00070506

Product Description

Catalog Number:

AG003PHX

Chemical Name:

DIETHYLDITHIOCARBAMIC ACID COPPER SALT

CAS Number:

13681-87-3

Molecular Formula:

C10H20CuN2S4

Molecular Weight:

360.0852

MDL Number:

MFCD00070506

IUPAC Name:

copper;N,N-diethylcarbamodithioate

InChI:

InChI=1S/2C5H11NS2.Cu/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/q;;+2/p-2

InChI Key:

OBBCYCYCTJQCCK-UHFFFAOYSA-L

SMILES:

CCN(C(=S)[S-])CC.CCN(C(=S)[S-])CC.[Cu+2]

Properties

Complexity:

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

358.981g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

360.07g/mol

Monoisotopic Mass:

358.981g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Induction of metallothionein isoforms by copper diethyldithiocarbamate in cultured vascular endothelial cells.	The Journal of toxicological sciences 20160401
Ni(II), Cu(II), and Zn(II) diethyldithiocarbamate complexes show various activities against the proteasome in breast cancer cells.	Journal of medicinal chemistry 20081023