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Chemical structure of 1,2-Propane-d6-diol

GC77122

1,2-Propane-d6-diol

Also listed as (±)-1,2-Propanediol-d6

(±)-1,2-Propanediol-d6 is the deuterium labeled (±)-1,2-Propanediol

ChemicalCAS52910-80-2MW82.13FormulaC3H2D6O2
CAS number
52910-80-2
Molecular weight
82.13
Formula
C3H2D6O2
Solubility
H2O： 250 mg/mL (3043·95 mM; Need ultrasonic)
InChIKey
DNIAPMSPPWPWGF-LIDOUZCJSA-N
Catalogue number
GC77122
Brand
GLPBIO
Computed properties PubChem CID 71309005 · XLogP -0.9 · TPSA 40.5 Ų · H-bond donors 2
XLogP
-0.9
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
5

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

Computed descriptors from PubChem (CID 71309005), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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