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Chemical structure of 1-Octanol-d17

GC74657

1-Octanol-d17

Also known as 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctan-1-ol

1-Octanol-d17 is the deuterium labeled 1-Octanol

ChemicalCAS153336-13-1MW147.33FormulaC8HD17O
CAS number
153336-13-1
Molecular weight
147.33
Formula
C8HD17O
Solubility
DMSO ： 100 mg/mL (678·75 mM; Need ultrasonic and warming)
InChIKey
KBPLFHHGFOOTCA-OISRNESJSA-N
Catalogue number
GC74657
Brand
GLPBIO
Computed properties PubChem CID 16212925 · XLogP 3 · TPSA 20.2 Ų · H-bond donors 1
XLogP
3
TPSA
20.2 Ų
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
9

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

Computed descriptors from PubChem (CID 16212925), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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