ethyl fluoro sulfate

C2H5FO4S — CID 88599587

IUPACethyl fluoro sulfate
SMILESCCOS(=O)(=O)OF
InChIInChI=1S/C2H5FO4S/c1-2-6-8(4,5)7-3/h2H2,1H3
InChIKeyBYHFOCUGLJNGRI-UHFFFAOYSA-N
MW144.12 g/mol
LogP0.17
Rot. Bonds3

About ethyl fluoro sulfate

ethyl fluoro sulfate (PubChem CID 88599587) has the molecular formula C2H5FO4S and a molecular weight of 144.12 g/mol. Its IUPAC name is ethyl fluoro sulfate.

Molecular Properties

Compound Nameethyl fluoro sulfate
PubChem CID88599587
Molecular FormulaC2H5FO4S
Molecular Weight144.12 g/mol
Exact Mass143.99
IUPAC Nameethyl fluoro sulfate
SMILESCCOS(=O)(=O)OF
InChIInChI=1S/C2H5FO4S/c1-2-6-8(4,5)7-3/h2H2,1H3
InChIKeyBYHFOCUGLJNGRI-UHFFFAOYSA-N
XLogP0.17
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.12
LogP ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

CID 159839688
CID 159839688
diethyl sulfate;sulfuric acid
CID 158458335
diethyl sulfate;iodoethane
CID 157176238
1-chloroethyl ethyl sulfate
CID 129187155
ethyl propyl sulfate;hydrochloride
CID 175489043
lithium;ethoxysulfonyl methanesulfonate;hydride
CID 174759292
lithium;ethyl trifluoromethoxy sulfate;hydride
CID 174759625
lithium;difluoromethoxy ethyl sulfate;hydride
CID 174759627
ethoxysulfonyl sulfite
CID 57240233
ethyl N,N-difluorosulfamate
CID 155476897
ethyl methanesulfonate;hydrofluoride
CID 174826290
bromosulfonyloxyethane
CID 154228998

Frequently Asked Questions

What is the IUPAC name of ethyl fluoro sulfate?
The IUPAC name of ethyl fluoro sulfate (CID 88599587) is ethyl fluoro sulfate.
What is the SMILES notation for ethyl fluoro sulfate?
The canonical SMILES for ethyl fluoro sulfate is CCOS(=O)(=O)OF.
What is the InChIKey of ethyl fluoro sulfate?
The InChIKey is BYHFOCUGLJNGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5FO4S/c1-2-6-8(4,5)7-3/h2H2,1H3.
What are the key properties of ethyl fluoro sulfate?
ethyl fluoro sulfate has a molecular weight of 144.12 g/mol, XLogP of 0.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl fluoro sulfate is sourced from PubChem (CID 88599587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).