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Ethylamine Hydrochloride-d3

CAT: 0572-TRC-E898293-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-E898293-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
64585-12-2
Synonyms
Ethan-2,2,2-d3-amine, hydrochloride (9CI); 2,2,2-Trideuterioethanamine hydrochloride; Ethan-2,2,2-d3-amine hydrochloride; Ethylamine-d3 hydrochloride; N-(Ethyl-2,2,2-d3)ammonium chloride; Ethylamine-2,2,2-D3 hydrochloride
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Cl.[2H]C([2H])([2H])CN
Molecular Formula
C2 D3 H4 N . Cl H
Molecular Weight
84.563
InChI
InChI=1S/C2H7N.ClH/c1-2-3;/h2-3H2,1H3;1H/i1D3;
Additionnal Information
IUPAC name: 2,2,2-trideuterioethanamine;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Ethyl-2,2,2-d3-amine HCl
CAS Number64585-12-2
PubChem CID12203876
IUPAC Name2,2,2-trideuterioethanamine;hydrochloride
Molecular FormulaC2H8ClN
Molecular Weight84.56
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity2
SMILES
[2H]C([2H])([2H])CN.Cl
InChI
InChI=1S/C2H7N.ClH/c1-2-3;/h2-3H2,1H3;1H/i1D3;
InChIKey
XWBDWHCCBGMXKG-NIIDSAIPSA-N
Chemical Structure
2D Structure
2D structure of Ethyl-2,2,2-d3-amine HCl
CAS: 64585-12-2
CID: 12203876
Formula: C2H8ClN
MW: 84.56
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight84.56
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass84.0533572
Monoisotopic Mass84.0533572
Topological Polar Surface Area26 Ų
Heavy Atom Count4
Formal Charge0
Complexity2.8
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes