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Iodoethane-1,1-d2 (Stabilized with Copper)

CAT: 0572-TRC-I705874-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-I705874-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3652-82-2
Synonyms
Ethyl-1,1-d2 Iodide; Ethyl Iodide-1,1-d2
Hazard Statement
Harmful if swallowed.
Smiles
[2H]C([2H])(C)I
Molecular Formula
C2 D2 H3 I
Molecular Weight
157.98
InChI
InChI=1S/C2H5I/c1-2-3/h2H2,1H3/i2D2
Additionnal Information
IUPAC name: 1,1-dideuterio-1-iodoethane
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Iodoethane-1,1-d2
CAS Number3652-82-2
PubChem CID12208629
IUPAC Name1,1-dideuterio-1-iodoethane
Molecular FormulaC2H5I
Molecular Weight157.98
XLogP2.1
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count3
Formal Charge0
Complexity2
SMILES
[2H]C([2H])(C)I
InChI
InChI=1S/C2H5I/c1-2-3/h2H2,1H3/i2D2
InChIKey
HVTICUPFWKNHNG-CBTSVUPCSA-N
Chemical Structure
2D Structure
2D structure of Iodoethane-1,1-d2
CAS: 3652-82-2
CID: 12208629
Formula: C2H5I
MW: 157.98
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight157.98
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass157.95615
Monoisotopic Mass157.95615
Topological Polar Surface Area0 Ų
Heavy Atom Count3
Formal Charge0
Complexity2.8
Isotope Atom Count2
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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