heptadecane;hypofluorous acid

C17H37FO — CID 158426244

IUPACheptadecane;hypofluorous acid
SMILESCCCCCCCCCCCCCCCCC.OF
InChIInChI=1S/C17H36.FHO/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-2/h3-17H2,1-2H3;2H
InChIKeyBVDGIUXHAXZRBY-UHFFFAOYSA-N
MW276.48 g/mol
LogP6.74
Rot. Bonds14

About heptadecane;hypofluorous acid

heptadecane;hypofluorous acid (PubChem CID 158426244) has the molecular formula C17H37FO and a molecular weight of 276.48 g/mol. Its IUPAC name is heptadecane;hypofluorous acid.

Molecular Properties

Compound Nameheptadecane;hypofluorous acid
PubChem CID158426244
Molecular FormulaC17H37FO
Molecular Weight276.48 g/mol
Exact Mass276.28
IUPAC Nameheptadecane;hypofluorous acid
SMILESCCCCCCCCCCCCCCCCC.OF
InChIInChI=1S/C17H36.FHO/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-2/h3-17H2,1-2H3;2H
InChIKeyBVDGIUXHAXZRBY-UHFFFAOYSA-N
XLogP6.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.48
LogP ≤ 56.74
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

heptane;zirconium
CID 159449678
methanol;undecane
CID 161373911
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
henoctacontane
CID 22086342
CID 161246447
CID 161246447
triacontane
CID 12535
dictane
CID 19848341
dohexacontane
CID 522644

Frequently Asked Questions

What is the IUPAC name of heptadecane;hypofluorous acid?
The IUPAC name of heptadecane;hypofluorous acid (CID 158426244) is heptadecane;hypofluorous acid.
What is the SMILES notation for heptadecane;hypofluorous acid?
The canonical SMILES for heptadecane;hypofluorous acid is CCCCCCCCCCCCCCCCC.OF.
What is the InChIKey of heptadecane;hypofluorous acid?
The InChIKey is BVDGIUXHAXZRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36.FHO/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-2/h3-17H2,1-2H3;2H.
What are the key properties of heptadecane;hypofluorous acid?
heptadecane;hypofluorous acid has a molecular weight of 276.48 g/mol, XLogP of 6.74, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for heptadecane;hypofluorous acid is sourced from PubChem (CID 158426244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).