carbonofluoridic acid;ethenyl acetate

C5H7FO4 — CID 157176220

IUPACcarbonofluoridic acid;ethenyl acetate
SMILESC=COC(C)=O.O=C(O)F
InChIInChI=1S/C4H6O2.CHFO2/c1-3-6-4(2)5;2-1(3)4/h3H,1H2,2H3;(H,3,4)
InChIKeyAOANMOLKQQXRCC-UHFFFAOYSA-N
MW150.10 g/mol
LogP1.33
Rot. Bonds1

About carbonofluoridic acid;ethenyl acetate

carbonofluoridic acid;ethenyl acetate (PubChem CID 157176220) has the molecular formula C5H7FO4 and a molecular weight of 150.10 g/mol. Its IUPAC name is carbonofluoridic acid;ethenyl acetate.

Molecular Properties

Compound Namecarbonofluoridic acid;ethenyl acetate
PubChem CID157176220
Molecular FormulaC5H7FO4
Molecular Weight150.10 g/mol
Exact Mass150.03
IUPAC Namecarbonofluoridic acid;ethenyl acetate
SMILESC=COC(C)=O.O=C(O)F
InChIInChI=1S/C4H6O2.CHFO2/c1-3-6-4(2)5;2-1(3)4/h3H,1H2,2H3;(H,3,4)
InChIKeyAOANMOLKQQXRCC-UHFFFAOYSA-N
XLogP1.33
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.10
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

ethenyl acetate
CID 7904
ethene;ethenyl acetate;hydrofluoride
CID 158693082
bis((Z)-but-2-enedioic acid);ethenyl acetate
CID 172778933
acetic acid;acetyl acetate;ethenyl acetate
CID 158501483
acetic acid;ethenyl acetate;guanidine;palladium
CID 174359280
ethenyl acetate;formic acid
CID 175608061
ethenyl acetate;methoxyethene
CID 18921270
(Z)-but-2-enedioic acid;ethene;ethenyl acetate
CID 174897820
tris(benzene-1,2,3,4,5,6-hexacarboxylic acid);ethenyl acetate
CID 174249995
CID 22321303
CID 22321303
ethanol;ethenyl acetate
CID 87099759
ethenyl acetate;oxalonitrile
CID 174923759

Frequently Asked Questions

What is the IUPAC name of carbonofluoridic acid;ethenyl acetate?
The IUPAC name of carbonofluoridic acid;ethenyl acetate (CID 157176220) is carbonofluoridic acid;ethenyl acetate.
What is the SMILES notation for carbonofluoridic acid;ethenyl acetate?
The canonical SMILES for carbonofluoridic acid;ethenyl acetate is C=COC(C)=O.O=C(O)F.
What is the InChIKey of carbonofluoridic acid;ethenyl acetate?
The InChIKey is AOANMOLKQQXRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2.CHFO2/c1-3-6-4(2)5;2-1(3)4/h3H,1H2,2H3;(H,3,4).
What are the key properties of carbonofluoridic acid;ethenyl acetate?
carbonofluoridic acid;ethenyl acetate has a molecular weight of 150.10 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbonofluoridic acid;ethenyl acetate is sourced from PubChem (CID 157176220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).