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4,4′-Dipyridyl-d8

CAT: 0804-HY-W017289S-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W017289S-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
4,4′-Dipyridyl-d8 is the deuterium labeled 4,4'-Dipyridyl. 4,4′-Dipyridyl is a heterocyclic compound. 4,4′-Dipyridyl is utilized as an electronic and photosensitive building block and bidentate ligand in supramolecular chemistry. 4,4′-Dipyridyl can also be used as a drug intermediate in the synthesis of paraquat, a widely used herbicide.
CAS Number
132125-39-4
UNSPSC
12352005
Hazard Statement
H301-H315-H319-H335
Target
Drug Intermediate; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Others
Field of Research
Others
Solubility
10 mM in DMSO
Smiles
[2H]C1=C(C2=C([2H])C([2H])=NC([2H])=C2[2H])C([2H])=C([2H])N=C1[2H]
Molecular Formula
C10D8N2
Molecular Weight
164.23
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53 (2) :211-216.
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

4,4'-Dipyridyl-D8
CAS Number132125-39-4
PubChem CID16217606
IUPAC Name2,3,5,6-tetradeuterio-4-(2,3,5,6-tetradeuterio-4-pyridinyl)pyridine
Molecular FormulaC10H8N2
Molecular Weight164.23
XLogP1.4
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity108
SMILES
[2H]C1=C(N=C(C(=C1C2=C(C(=NC(=C2[2H])[2H])[2H])[2H])[2H])[2H])[2H]
InChI
InChI=1S/C10H8N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H/i1D,2D,3D,4D,5D,6D,7D,8D
InChIKey
MWVTWFVJZLCBMC-PGRXLJNUSA-N
Chemical Structure
2D Structure
2D structure of 4,4'-Dipyridyl-D8
CAS: 132125-39-4
CID: 16217606
Formula: C10H8N2
MW: 164.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight164.23
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass164.118962231
Monoisotopic Mass164.118962231
Topological Polar Surface Area25.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity108
Isotope Atom Count8
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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Alternative Products

CatalogName
CS-T-945824,4'-Dipyridyl-d8
Fr144044,4′-Dipyridyl
GK1003-5g4,4''-Dipyridyl
25579154-014,4'-Dipyridyl
FB12039-014,4'-Dipyridyl - 98%
233590-014,4'-Dipyridyl 99+%
OR70914,4'-Dipyridyl hydrate
D5110-014,4'-DIPYRIDYL DISULFIDE
sc-2307792,2'-Dipyridyl-d8
sc-4870714,4'-Dipyridyl Sulfide

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