prop-2-enoxy hypofluorite

C3H5FO2 — CID 173305513

IUPACprop-2-enoxy hypofluorite
SMILESC=CCOOF
InChIInChI=1S/C3H5FO2/c1-2-3-5-6-4/h2H,1,3H2
InChIKeyLYJIHHTYKRHIHI-UHFFFAOYSA-N
MW92.07 g/mol
LogP1.01
Rot. Bonds3

About prop-2-enoxy hypofluorite

prop-2-enoxy hypofluorite (PubChem CID 173305513) has the molecular formula C3H5FO2 and a molecular weight of 92.07 g/mol. Its IUPAC name is prop-2-enoxy hypofluorite.

Molecular Properties

Compound Nameprop-2-enoxy hypofluorite
PubChem CID173305513
Molecular FormulaC3H5FO2
Molecular Weight92.07 g/mol
Exact Mass92.03
IUPAC Nameprop-2-enoxy hypofluorite
SMILESC=CCOOF
InChIInChI=1S/C3H5FO2/c1-2-3-5-6-4/h2H,1,3H2
InChIKeyLYJIHHTYKRHIHI-UHFFFAOYSA-N
XLogP1.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.07
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Hydroperoxide, 2-propenyl
CID 10982484
Dioxole
CID 21189139
Allylperoxide
CID 21879911
4H-trioxine
CID 23616487
Prop-2-enyl hypofluorite
CID 21254194
[Oxo(prop-2-enoxy)silyl] hypofluorite
CID 87892460
3-(Fluoromethylperoxy)prop-1-ene
CID 91254114
Prop-1-enoxy hypofluorite
CID 173375021
Allyl iodate
CID 129670593
Prop-2-en-1-olate
CID 154718859
1-Fluoro-3-hydroperoxyprop-1-ene
CID 174702941
3-Ethenylperoxy-1-fluoroprop-1-ene
CID 174965755

Frequently Asked Questions

What is the IUPAC name of prop-2-enoxy hypofluorite?
The IUPAC name of prop-2-enoxy hypofluorite (CID 173305513) is prop-2-enoxy hypofluorite.
What is the SMILES notation for prop-2-enoxy hypofluorite?
The canonical SMILES for prop-2-enoxy hypofluorite is C=CCOOF.
What is the InChIKey of prop-2-enoxy hypofluorite?
The InChIKey is LYJIHHTYKRHIHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5FO2/c1-2-3-5-6-4/h2H,1,3H2.
What are the key properties of prop-2-enoxy hypofluorite?
prop-2-enoxy hypofluorite has a molecular weight of 92.07 g/mol, XLogP of 1.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enoxy hypofluorite is sourced from PubChem (CID 173305513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).