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Bromodiiodomethane - 85%, high purity , CAS No.557-95-9
Basic Description
Synonyms
bromo(diiodo)methane | PTGIGXMFLYACDM-UHFFFAOYSA-N | BDIM | Bromodiiodomethane (>85per cent) | DTXSID70204235 | AKOS030254988 | SCHEMBL1040225 | Bromodiiodomethane | Methane, bromodiiodo-
Specifications & Purity
≥85%
Storage Temp
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description
Product Application:
Bromodiiodomethane, is a Iodinated trihalomethanes (ITHMs),which can be used for several medicinal or pharmaceutical taste and odor events in drinking water.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Alkyl halides
Subclass
Halomethanes
Intermediate Tree Nodes
Not available
Direct Parent
Trihalomethanes
Alternative Parents
Organoiodides Organobromides Hydrocarbon derivatives Alkyl iodides Alkyl bromides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Trihalomethane - Hydrocarbon derivative - Organoiodide - Organobromide - Alkyl iodide - Alkyl bromide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as trihalomethanes. These are organic compounds in which exactly three of the four hydrogen atoms of methane (CH4) are replaced by halogen atoms.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
488184136
IUPAC Name
bromo(diiodo)methane
INCHI
InChI=1S/CHBrI2/c2-1(3)4/h1H
InChIKey
PTGIGXMFLYACDM-UHFFFAOYSA-N
Smiles
C(Br)(I)I
Isomeric SMILES
C(Br)(I)I
Molecular Weight
346.73
Reaxy-Rn
1697009
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697009&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Chloroform (Soluble), Ethyl Acetate (Slightly)
Sensitivity
Light sensitive
Melt Point(°C)
>49°C (dec.)
Molecular Weight
346.730 g/mol
XLogP3
2.500
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
0
Exact Mass
345.735 Da
Monoisotopic Mass
345.735 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
4
Formal Charge
0
Complexity
13.500
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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C23151788