10,10,10-trideuteriodecan-1-ol

C10H22O — CID 132935619

IUPAC10,10,10-trideuteriodecan-1-ol
SMILES[2H]C([2H])([2H])CCCCCCCCCO
InChIInChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3/i1D3
InChIKeyMWKFXSUHUHTGQN-FIBGUPNXSA-N
MW161.30 g/mol
LogP3.12
Rot. Bonds9

About 10,10,10-trideuteriodecan-1-ol

10,10,10-trideuteriodecan-1-ol (PubChem CID 132935619) has the molecular formula C10H22O and a molecular weight of 161.30 g/mol. Its IUPAC name is 10,10,10-trideuteriodecan-1-ol.

Molecular Properties

Compound Name10,10,10-trideuteriodecan-1-ol
PubChem CID132935619
Molecular FormulaC10H22O
Molecular Weight161.30 g/mol
Exact Mass161.19
IUPAC Name10,10,10-trideuteriodecan-1-ol
SMILES[2H]C([2H])([2H])CCCCCCCCCO
InChIInChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3/i1D3
InChIKeyMWKFXSUHUHTGQN-FIBGUPNXSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-deuteriopentan-1-ol
CID 58290914
decane;decan-1-ol
CID 22418527
dohexacontan-1-ol
CID 22501426
dodecan-1-ol;tetradecan-1-ol
CID 21281432
heptan-1-ol;nonan-1-ol
CID 160785033
heptatriacontan-1-ol
CID 537071
decane-1,10-diol;heptan-1-ol;nonan-1-ol;pentan-1-ol;tridecan-1-ol
CID 159582596
nonadecakis(heptane);nonan-1-ol
CID 173279398
undecan-1-ol
CID 122455065
hexan-1-ol;nonan-1-ol
CID 159104620
nonan-1-ol;tetradecan-1-ol
CID 174944242
hexan-1-ol;nonane
CID 175106830

Frequently Asked Questions

What is the IUPAC name of 10,10,10-trideuteriodecan-1-ol?
The IUPAC name of 10,10,10-trideuteriodecan-1-ol (CID 132935619) is 10,10,10-trideuteriodecan-1-ol.
What is the SMILES notation for 10,10,10-trideuteriodecan-1-ol?
The canonical SMILES for 10,10,10-trideuteriodecan-1-ol is [2H]C([2H])([2H])CCCCCCCCCO.
What is the InChIKey of 10,10,10-trideuteriodecan-1-ol?
The InChIKey is MWKFXSUHUHTGQN-FIBGUPNXSA-N. The full InChI is InChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3/i1D3.
What are the key properties of 10,10,10-trideuteriodecan-1-ol?
10,10,10-trideuteriodecan-1-ol has a molecular weight of 161.30 g/mol, XLogP of 3.12, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10,10-trideuteriodecan-1-ol is sourced from PubChem (CID 132935619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).