pentoxy hypofluorite

C5H11FO2 — CID 164522795

IUPACpentoxy hypofluorite
SMILESCCCCCOOF
InChIInChI=1S/C5H11FO2/c1-2-3-4-5-7-8-6/h2-5H2,1H3
InChIKeySDUHHYAQVRGONJ-UHFFFAOYSA-N
MW122.14 g/mol
LogP2.01
Rot. Bonds5

About pentoxy hypofluorite

pentoxy hypofluorite (PubChem CID 164522795) has the molecular formula C5H11FO2 and a molecular weight of 122.14 g/mol. Its IUPAC name is pentoxy hypofluorite.

Molecular Properties

Compound Namepentoxy hypofluorite
PubChem CID164522795
Molecular FormulaC5H11FO2
Molecular Weight122.14 g/mol
Exact Mass122.07
IUPAC Namepentoxy hypofluorite
SMILESCCCCCOOF
InChIInChI=1S/C5H11FO2/c1-2-3-4-5-7-8-6/h2-5H2,1H3
InChIKeySDUHHYAQVRGONJ-UHFFFAOYSA-N
XLogP2.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.14
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

1-octylperoxynonane
CID 151564626
1-pentylperoxypentane;sulfane
CID 174916685
1-butylperoxyperoxynonane
CID 90169675
1-methylperoxydocosane
CID 173387093
1-butoxyperoxynonane
CID 90110144
1-methylperoxydecane
CID 20726912
1-butylperoxybutane
CID 159275797
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1-(2-nonoxyethoxy)nonane
CID 87982931
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862

Frequently Asked Questions

What is the IUPAC name of pentoxy hypofluorite?
The IUPAC name of pentoxy hypofluorite (CID 164522795) is pentoxy hypofluorite.
What is the SMILES notation for pentoxy hypofluorite?
The canonical SMILES for pentoxy hypofluorite is CCCCCOOF.
What is the InChIKey of pentoxy hypofluorite?
The InChIKey is SDUHHYAQVRGONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FO2/c1-2-3-4-5-7-8-6/h2-5H2,1H3.
What are the key properties of pentoxy hypofluorite?
pentoxy hypofluorite has a molecular weight of 122.14 g/mol, XLogP of 2.01, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pentoxy hypofluorite is sourced from PubChem (CID 164522795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).