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Chemical structure of 4-Methylpentanoic acid-d11

GC72572

4-Methylpentanoic acid-d11

Also known as 2,2,3,3,4,5,5,5-octadeuterio-4-(trideuteriomethyl)pentanoic acid

4-Methylpentanoic acid-d11 is the deuterium labeled 4-Methylpentanoic acid

ChemicalCAS344298-98-2MW127.23FormulaC6HD11O2
CAS number
344298-98-2
Molecular weight
127.23
Formula
C6HD11O2
InChIKey
FGKJLKRYENPLQH-KUXNVAAFSA-N
Catalogue number
GC72572
Brand
GLPBIO
Computed properties PubChem CID 57608845 · XLogP 1.4 · TPSA 37.3 Ų · H-bond donors 1
XLogP
1.4
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
8

SMILES [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])C(=O)O

Computed descriptors from PubChem (CID 57608845), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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