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Dichloroiodomethane

CAT: 0804-HY-133642-01Size: 1 mg (10 mM x 474 μL in Ethanol)Dry Ice: NoHazardous: No
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CAT#:0804-HY-133642-01Size:1 mg (10 mM x 474 μL in Ethanol)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Dichloroiodomethane is a natural compound in human beings[1].
CAS Number
594-04-7
UNSPSC
12352200
Target
Endogenous Metabolite
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/dichloroiodomethane.html
Concentration
10 mM * 474 μL in Ethanol
Purity
95
Solubility
10 mM in DMSO
Smiles
IC(Cl)Cl
Molecular Formula
CHCl2I
Molecular Weight
210.83
References & Citations
[1]Lalith K. Silva, et al. Quantification of Dichloroiodomethane and Bromochloroiodomethane in Human Blood by Solid-Phase Microextraction Coupled with Gas Chromatography-High-Resolution Mass Spectrometry. Journal of Analytical Toxicology, Volume 30, Issue 9, November-December 2006, Pages 670-678.
Shipping Conditions
Blue Ice
Storage Conditions
Solution, -20°C, protect from light, 2 years
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported
Isoform
Human Endogenous Metabolite

Chemical Information

Dichloroiodomethane
CAS Number594-04-7
PubChem CID11655
IUPAC Namedichloro(iodo)methane
Molecular FormulaCHCl2I
Molecular Weight210.83
XLogP2.3
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity13
SMILES
C(Cl)(Cl)I
InChI
InChI=1S/CHCl2I/c2-1(3)4/h1H
InChIKey
HNLZCOJXSLDGKD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dichloroiodomethane
CAS: 594-04-7
CID: 11655
Formula: CHCl2I
MW: 210.83
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight210.83
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass209.85000
Monoisotopic Mass209.85000
Topological Polar Surface Area0 Ų
Heavy Atom Count4
Formal Charge0
Complexity13.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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