carbonofluoridic acid;ethenyl carbonofluoridate

C4H4F2O4 — CID 175081122

IUPACcarbonofluoridic acid;ethenyl carbonofluoridate
SMILESC=COC(=O)F.O=C(O)F
InChIInChI=1S/C3H3FO2.CHFO2/c1-2-6-3(4)5;2-1(3)4/h2H,1H2;(H,3,4)
InChIKeyDPBHQNYBZMGSFE-UHFFFAOYSA-N
MW154.07 g/mol
LogP1.87
Rot. Bonds1

About carbonofluoridic acid;ethenyl carbonofluoridate

carbonofluoridic acid;ethenyl carbonofluoridate (PubChem CID 175081122) has the molecular formula C4H4F2O4 and a molecular weight of 154.07 g/mol. Its IUPAC name is carbonofluoridic acid;ethenyl carbonofluoridate.

Molecular Properties

Compound Namecarbonofluoridic acid;ethenyl carbonofluoridate
PubChem CID175081122
Molecular FormulaC4H4F2O4
Molecular Weight154.07 g/mol
Exact Mass154.01
IUPAC Namecarbonofluoridic acid;ethenyl carbonofluoridate
SMILESC=COC(=O)F.O=C(O)F
InChIInChI=1S/C3H3FO2.CHFO2/c1-2-6-3(4)5;2-1(3)4/h2H,1H2;(H,3,4)
InChIKeyDPBHQNYBZMGSFE-UHFFFAOYSA-N
XLogP1.87
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.07
LogP ≤ 51.87
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

carbonofluoridic acid;ethenyl acetate
CID 157176220
ethenyl hydrogen carbonate;methane
CID 175034349
hexakis(carbonofluoridic acid);prop-2-enoic acid
CID 175140796
bis(ethenyl) carbonate;ethene
CID 87073622
carbonofluoridic acid
CID 118456839
ethenyl acetate
CID 7904
(Z)-2-ethenoxybut-2-enoic acid
CID 142329685
acetic acid;ethenyl acetate;guanidine;palladium
CID 174359280
carbamic acid;ethenyl hypofluorite
CID 174867044
bis(ethenyl) (Z)-but-2-enedioate;ethene
CID 174990906
carbonofluoridic acid;thorium
CID 88532553
acetonitrile;ethenyl hydrogen carbonate
CID 174594655

Frequently Asked Questions

What is the IUPAC name of carbonofluoridic acid;ethenyl carbonofluoridate?
The IUPAC name of carbonofluoridic acid;ethenyl carbonofluoridate (CID 175081122) is carbonofluoridic acid;ethenyl carbonofluoridate.
What is the SMILES notation for carbonofluoridic acid;ethenyl carbonofluoridate?
The canonical SMILES for carbonofluoridic acid;ethenyl carbonofluoridate is C=COC(=O)F.O=C(O)F.
What is the InChIKey of carbonofluoridic acid;ethenyl carbonofluoridate?
The InChIKey is DPBHQNYBZMGSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3FO2.CHFO2/c1-2-6-3(4)5;2-1(3)4/h2H,1H2;(H,3,4).
What are the key properties of carbonofluoridic acid;ethenyl carbonofluoridate?
carbonofluoridic acid;ethenyl carbonofluoridate has a molecular weight of 154.07 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbonofluoridic acid;ethenyl carbonofluoridate is sourced from PubChem (CID 175081122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).