ethyl fluoromethyl sulfite

C3H7FO3S — CID 87154992

IUPACethyl fluoromethyl sulfite
SMILESCCOS(=O)OCF
InChIInChI=1S/C3H7FO3S/c1-2-6-8(5)7-3-4/h2-3H2,1H3
InChIKeyIVDVAFVIURLMPZ-UHFFFAOYSA-N
MW142.15 g/mol
LogP0.55
Rot. Bonds4

About ethyl fluoromethyl sulfite

ethyl fluoromethyl sulfite (PubChem CID 87154992) has the molecular formula C3H7FO3S and a molecular weight of 142.15 g/mol. Its IUPAC name is ethyl fluoromethyl sulfite.

Molecular Properties

Compound Nameethyl fluoromethyl sulfite
PubChem CID87154992
Molecular FormulaC3H7FO3S
Molecular Weight142.15 g/mol
Exact Mass142.01
IUPAC Nameethyl fluoromethyl sulfite
SMILESCCOS(=O)OCF
InChIInChI=1S/C3H7FO3S/c1-2-6-8(5)7-3-4/h2-3H2,1H3
InChIKeyIVDVAFVIURLMPZ-UHFFFAOYSA-N
XLogP0.55
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.15
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl fluoromethyl sulfite?
The IUPAC name of ethyl fluoromethyl sulfite (CID 87154992) is ethyl fluoromethyl sulfite.
What is the SMILES notation for ethyl fluoromethyl sulfite?
The canonical SMILES for ethyl fluoromethyl sulfite is CCOS(=O)OCF.
What is the InChIKey of ethyl fluoromethyl sulfite?
The InChIKey is IVDVAFVIURLMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7FO3S/c1-2-6-8(5)7-3-4/h2-3H2,1H3.
What are the key properties of ethyl fluoromethyl sulfite?
ethyl fluoromethyl sulfite has a molecular weight of 142.15 g/mol, XLogP of 0.55, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl fluoromethyl sulfite is sourced from PubChem (CID 87154992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).