6-fluorohexan-1-ol

C6H13FO — CID 9768

IUPAC6-fluorohexan-1-ol
SMILESOCCCCCCF
InChIInChI=1S/C6H13FO/c7-5-3-1-2-4-6-8/h8H,1-6H2
InChIKeyJWCOWLWBOYGUPA-UHFFFAOYSA-N
MW120.17 g/mol
LogP1.51
Rot. Bonds5

About 6-fluorohexan-1-ol

6-fluorohexan-1-ol (PubChem CID 9768) has the molecular formula C6H13FO and a molecular weight of 120.17 g/mol. Its IUPAC name is 6-fluorohexan-1-ol.

Molecular Properties

Compound Name6-fluorohexan-1-ol
PubChem CID9768
Molecular FormulaC6H13FO
Molecular Weight120.17 g/mol
Exact Mass120.10
IUPAC Name6-fluorohexan-1-ol
SMILESOCCCCCCF
InChIInChI=1S/C6H13FO/c7-5-3-1-2-4-6-8/h8H,1-6H2
InChIKeyJWCOWLWBOYGUPA-UHFFFAOYSA-N
XLogP1.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.17
LogP ≤ 51.51
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

hexane-1,6-diol;octane-1,8-diol
CID 21202869
pentadecane-1,15-diol
CID 518994
trioctacontane-1,83-diol
CID 87526146
heptane-1,7-diol;nonane-1,9-diol
CID 174499055
tricosane-1,23-diol
CID 25144332
dodecane-1,12-diol;tridecane-1,13-diol
CID 87338508
tris(docosane-1,22-diol);octakis(heptadecane-1,17-diol)
CID 159258975
CID 158555375
CID 158555375
1,9-difluorononane;hydrochloride
CID 174355742
hexane-1,6-diol;hydroiodide
CID 175146639
methanediol;pentane-1,5-diol
CID 90027781
methane;tridecane-1,13-diol
CID 174975453

Frequently Asked Questions

What is the IUPAC name of 6-fluorohexan-1-ol?
The IUPAC name of 6-fluorohexan-1-ol (CID 9768) is 6-fluorohexan-1-ol.
What is the SMILES notation for 6-fluorohexan-1-ol?
The canonical SMILES for 6-fluorohexan-1-ol is OCCCCCCF.
What is the InChIKey of 6-fluorohexan-1-ol?
The InChIKey is JWCOWLWBOYGUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FO/c7-5-3-1-2-4-6-8/h8H,1-6H2.
What are the key properties of 6-fluorohexan-1-ol?
6-fluorohexan-1-ol has a molecular weight of 120.17 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluorohexan-1-ol is sourced from PubChem (CID 9768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).