fluoro propyl carbonate

C4H7FO3 — CID 18542732

IUPACfluoro propyl carbonate
SMILESCCCOC(=O)OF
InChIInChI=1S/C4H7FO3/c1-2-3-7-4(6)8-5/h2-3H2,1H3
InChIKeySJVXPDMPKPKEMD-UHFFFAOYSA-N
MW122.09 g/mol
LogP1.43
Rot. Bonds2

About fluoro propyl carbonate

fluoro propyl carbonate (PubChem CID 18542732) has the molecular formula C4H7FO3 and a molecular weight of 122.09 g/mol. Its IUPAC name is fluoro propyl carbonate.

Molecular Properties

Compound Namefluoro propyl carbonate
PubChem CID18542732
Molecular FormulaC4H7FO3
Molecular Weight122.09 g/mol
Exact Mass122.04
IUPAC Namefluoro propyl carbonate
SMILESCCCOC(=O)OF
InChIInChI=1S/C4H7FO3/c1-2-3-7-4(6)8-5/h2-3H2,1H3
InChIKeySJVXPDMPKPKEMD-UHFFFAOYSA-N
XLogP1.43
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.09
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of fluoro propyl carbonate?
The IUPAC name of fluoro propyl carbonate (CID 18542732) is fluoro propyl carbonate.
What is the SMILES notation for fluoro propyl carbonate?
The canonical SMILES for fluoro propyl carbonate is CCCOC(=O)OF.
What is the InChIKey of fluoro propyl carbonate?
The InChIKey is SJVXPDMPKPKEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7FO3/c1-2-3-7-4(6)8-5/h2-3H2,1H3.
What are the key properties of fluoro propyl carbonate?
fluoro propyl carbonate has a molecular weight of 122.09 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro propyl carbonate is sourced from PubChem (CID 18542732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).