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Chemical structure of MCPA-d3

GC69441

MCPA-d3

Also known as 2-(4-chloro-2,3,5-trideuterio-6-methylphenoxy)acetic acid

MCPA-d3 is the deuterated form of MCPA· MCPA is a phenoxy herbicide widely used to control annual and perennial broadleaf weeds

ChemicalCAS352431-14-2MW203.64FormulaC9H6D3ClO3
CAS number
352431-14-2
Molecular weight
203.64
Formula
C9H6D3ClO3
Solubility
DMSO : 50 mg/mL (245·53 mM; Need ultrasonic)
InChIKey
WHKUVVPPKQRRBV-NRUYWUNFSA-N
Catalogue number
GC69441
Brand
GLPBIO
Computed properties PubChem CID 101016518 · XLogP 2.6 · TPSA 46.5 Ų · H-bond donors 1
XLogP
2.6
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(=C1OCC(=O)O)C)[2H])Cl)[2H]

Computed descriptors from PubChem (CID 101016518), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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