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Triethanolamine-d15

CAT: 0931-TMIJ-0524-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TMIJ-0524-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
73205-32-0
Bioactivity
Triethanolamine-d15 is a deuterated compound of Triethanolamine. Triethanolamine has a CAS number of 102-71-6.
Smiles
O([2H])C([2H])([2H])C([2H])([2H])N(C([2H])([2H])C([2H])([2H])O[2H])C([2H])([2H])C([2H])([2H])O[2H]
Molecular Formula
C6D15NO3
Molecular Weight
164.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Triethanolamine-d15
CAS Number73205-32-0
PubChem CID92043528
IUPAC Name1,1,2,2-tetradeuterio-2-deuteriooxy-N,N-bis(1,1,2,2-tetradeuterio-2-deuteriooxyethyl)ethanamine
Molecular FormulaC6H15NO3
Molecular Weight164.28
XLogP-1
Topological Polar Surface Area63.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count10
Formal Charge0
Complexity55
SMILES
[2H]C([2H])(C([2H])([2H])O[2H])N(C([2H])([2H])C([2H])([2H])O[2H])C([2H])([2H])C([2H])([2H])O[2H]
InChI
InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2/i1D2,2D2,3D2,4D2,5D2,6D2,8D,9D,10D
InChIKey
GSEJCLTVZPLZKY-BKMQWGEFSA-N
Chemical Structure
2D Structure
2D structure of Triethanolamine-d15
CAS: 73205-32-0
CID: 92043528
Formula: C6H15NO3
MW: 164.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight164.28
XLogP3-1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass164.19934453
Monoisotopic Mass164.19934453
Topological Polar Surface Area63.9 Ų
Heavy Atom Count10
Formal Charge0
Complexity55.7
Isotope Atom Count15
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes