Home Carbonyls 1,1'-Thiocarbonyldiimidazole

1,1'-Thiocarbonyldiimidazole

CAS No.:
6160-65-2
Catalog Number:
AG0032JV
Molecular Formula:
C7H6N4S
Molecular Weight:
178.2143
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$18
- +
25g
95%
In Stock USA
United States
$52
- +
100g
95%
In Stock USA
United States
$190
- +
Product Description
Catalog Number:
AG0032JV
Chemical Name:
1,1'-Thiocarbonyldiimidazole
CAS Number:
6160-65-2
Molecular Formula:
C7H6N4S
Molecular Weight:
178.2143
MDL Number:
MFCD00005289
IUPAC Name:
di(imidazol-1-yl)methanethione
InChI:
InChI=1S/C7H6N4S/c12-7(10-3-1-8-5-10)11-4-2-9-6-11/h1-6H
InChI Key:
RAFNCPHFRHZCPS-UHFFFAOYSA-N
SMILES:
S=C(n1cncc1)n1cncc1
EC Number:
228-183-4
NSC Number:
141692
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.213g/mol
Monoisotopic Mass:
178.031g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
On-tissue chemical derivatization of 3-methoxysalicylamine for MALDI-imaging mass spectrometry. Journal of mass spectrometry : JMS 20110801
Determination of 3-methoxysalicylamine levels in mouse plasma and tissue by liquid chromatography-tandem mass spectrometry: application to in vivo pharmacokinetics studies. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20110501
Antimycobacterial activity of novel 1-(5-cyclobutyl-1,3-oxazol-2-yl)-3-(sub)phenyl/pyridylthiourea compounds endowed with high activity toward multidrug-resistant Mycobacterium tuberculosis. The Journal of antimicrobial chemotherapy 20070601
Selective one-pot synthesis of trithiocarbonates, xanthates, and dithiocarbamates for use in RAFT/MADIX living radical polymerizations. Organic letters 20060216
3-Mercaptopropionic acid-nitrile imine adducts. An unprecedented cyclization into 1,3,4-thiadiazol-2(3H)-ones and -2(3H)-thiones. Organic & biomolecular chemistry 20050721
[Synthesis and antiprotozoal activity of [1,3]oxazino[4,5,6-de]quinolines]. Die Pharmazie 20040801
A specific HPLC-UV method for the determination of cysteine and related aminothiols in biological samples. Talanta 20030829
Specific determination of cysteine and penicillamine through cyclization to 2-thioxothiazolidine-4-carboxylic acids. Talanta 20020311
Antiproliferative activity of mixed-ligand dien-Cu(II) complexes with thiazole, thiazoline and imidazole derivatives. Journal of inorganic biochemistry 20020101
Properties