decan-1-ol;hydrofluoride

C10H23FO — CID 158778674

IUPACdecan-1-ol;hydrofluoride
SMILESCCCCCCCCCCO.F
InChIInChI=1S/C10H22O.FH/c1-2-3-4-5-6-7-8-9-10-11;/h11H,2-10H2,1H3;1H
InChIKeyBLLGFZMINNXPQK-UHFFFAOYSA-N
MW178.29 g/mol
LogP3.27
Rot. Bonds8

About decan-1-ol;hydrofluoride

decan-1-ol;hydrofluoride (PubChem CID 158778674) has the molecular formula C10H23FO and a molecular weight of 178.29 g/mol. Its IUPAC name is decan-1-ol;hydrofluoride.

Molecular Properties

Compound Namedecan-1-ol;hydrofluoride
PubChem CID158778674
Molecular FormulaC10H23FO
Molecular Weight178.29 g/mol
Exact Mass178.17
IUPAC Namedecan-1-ol;hydrofluoride
SMILESCCCCCCCCCCO.F
InChIInChI=1S/C10H22O.FH/c1-2-3-4-5-6-7-8-9-10-11;/h11H,2-10H2,1H3;1H
InChIKeyBLLGFZMINNXPQK-UHFFFAOYSA-N
XLogP3.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.29
LogP ≤ 53.27
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

decane;decan-1-ol
CID 22418527
dohexacontan-1-ol
CID 22501426
dodecan-1-ol;tetradecan-1-ol
CID 21281432
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
heptan-1-ol;nonan-1-ol
CID 160785033
heptatriacontan-1-ol
CID 537071
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
octan-1-ol;pentane-1,5-diol
CID 174867151

Frequently Asked Questions

What is the IUPAC name of decan-1-ol;hydrofluoride?
The IUPAC name of decan-1-ol;hydrofluoride (CID 158778674) is decan-1-ol;hydrofluoride.
What is the SMILES notation for decan-1-ol;hydrofluoride?
The canonical SMILES for decan-1-ol;hydrofluoride is CCCCCCCCCCO.F.
What is the InChIKey of decan-1-ol;hydrofluoride?
The InChIKey is BLLGFZMINNXPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O.FH/c1-2-3-4-5-6-7-8-9-10-11;/h11H,2-10H2,1H3;1H.
What are the key properties of decan-1-ol;hydrofluoride?
decan-1-ol;hydrofluoride has a molecular weight of 178.29 g/mol, XLogP of 3.27, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for decan-1-ol;hydrofluoride is sourced from PubChem (CID 158778674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).