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Chemical structure of 2,4-D-d5

GC75867

2,4-D-d5

Also known as 2,2-dideuterio-2-(2,4-dichloro-3,5,6-trideuteriophenoxy)acetic acid

2,4-D-d5 is the deuterium labeled 2,4-D

ChemicalCAS352438-69-8MW226.07FormulaC8HD5Cl2O3
CAS number
352438-69-8
Molecular weight
226.07
Formula
C8HD5Cl2O3
Solubility
DMSO： 100 mg/mL (442·34 mM; Need ultrasonic and warming)
InChIKey
OVSKIKFHRZPJSS-QUWGTZMWSA-N
Catalogue number
GC75867
Brand
GLPBIO
Computed properties PubChem CID 131852820 · XLogP 2.8 · TPSA 46.5 Ų · H-bond donors 1
XLogP
2.8
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13

SMILES [2H]C1=C(C(=C(C(=C1OC([2H])([2H])C(=O)O)Cl)[2H])Cl)[2H]

Computed descriptors from PubChem (CID 131852820), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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