ethyl fluoro carbonate

C3H5FO3 — CID 18542699

IUPACethyl fluoro carbonate
SMILESCCOC(=O)OF
InChIInChI=1S/C3H5FO3/c1-2-6-3(5)7-4/h2H2,1H3
InChIKeyMUPRUEGWJTZSMK-UHFFFAOYSA-N
MW108.07 g/mol
LogP1.04
Rot. Bonds1

About ethyl fluoro carbonate

ethyl fluoro carbonate (PubChem CID 18542699) has the molecular formula C3H5FO3 and a molecular weight of 108.07 g/mol. Its IUPAC name is ethyl fluoro carbonate.

Molecular Properties

Compound Nameethyl fluoro carbonate
PubChem CID18542699
Molecular FormulaC3H5FO3
Molecular Weight108.07 g/mol
Exact Mass108.02
IUPAC Nameethyl fluoro carbonate
SMILESCCOC(=O)OF
InChIInChI=1S/C3H5FO3/c1-2-6-3(5)7-4/h2H2,1H3
InChIKeyMUPRUEGWJTZSMK-UHFFFAOYSA-N
XLogP1.04
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.07
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

difluoromethane;ethyl fluoro carbonate
CID 175519829
CID 175796855
CID 175796855
magnesium;diethyl carbonate;hydride
CID 173249173
acetylene;diethyl carbonate
CID 87073597
diethyl carbonate;ethane-1,2-diol
CID 19764063
diethyl carbonate;N,N-dimethylmethanamine
CID 88502244
ethyl 1-fluoroethyl carbonate
CID 11491942
ethoxycarbonyl acetate
CID 169432619
amino ethyl carbonate;ethanol
CID 158439485
diethyl carbonate;dimethyl carbonate;ethyl methyl carbonate
CID 87546918
ethanol;ethyl methyl carbonate
CID 161101393
ethoxycarbonyloxymethoxymethyl ethyl carbonate
CID 142756637

Frequently Asked Questions

What is the IUPAC name of ethyl fluoro carbonate?
The IUPAC name of ethyl fluoro carbonate (CID 18542699) is ethyl fluoro carbonate.
What is the SMILES notation for ethyl fluoro carbonate?
The canonical SMILES for ethyl fluoro carbonate is CCOC(=O)OF.
What is the InChIKey of ethyl fluoro carbonate?
The InChIKey is MUPRUEGWJTZSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5FO3/c1-2-6-3(5)7-4/h2H2,1H3.
What are the key properties of ethyl fluoro carbonate?
ethyl fluoro carbonate has a molecular weight of 108.07 g/mol, XLogP of 1.04, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl fluoro carbonate is sourced from PubChem (CID 18542699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).