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Chemical structure of Diacetolol D7

GC60764

Diacetolol D7

Also known as N-[3-acetyl-4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-hydroxypropoxy]phenyl]acetamide

Diacetolol D7 is a deuterium labeled Diacetolol

ChemicalCAS1346604-19-0MW315.42FormulaC16H17D7N2O4
CAS number
1346604-19-0
Molecular weight
315.42
Formula
C16H17D7N2O4
InChIKey
AWOGXJOBNAWQSF-SVMCCORHSA-N
Catalogue number
GC60764
Brand
GLPBIO
Computed properties PubChem CID 71315864 · XLogP 0.9 · TPSA 87.7 Ų · H-bond donors 3
XLogP
0.9
TPSA
87.7 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
22

SMILES [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])NCC(COC1=C(C=C(C=C1)NC(=O)C)C(=O)C)O

Computed descriptors from PubChem (CID 71315864), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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