2-fluoroethyl methyl carbonate

C4H7FO3 — CID 53235554

IUPAC2-fluoroethyl methyl carbonate
SMILESCOC(=O)OCCF
InChIInChI=1S/C4H7FO3/c1-7-4(6)8-3-2-5/h2-3H2,1H3
InChIKeyNOLGJZJMWUDWQW-UHFFFAOYSA-N
MW122.09 g/mol
LogP0.74
Rot. Bonds2

About 2-fluoroethyl methyl carbonate

2-fluoroethyl methyl carbonate (PubChem CID 53235554) has the molecular formula C4H7FO3 and a molecular weight of 122.09 g/mol. Its IUPAC name is 2-fluoroethyl methyl carbonate.

Molecular Properties

Compound Name2-fluoroethyl methyl carbonate
PubChem CID53235554
Molecular FormulaC4H7FO3
Molecular Weight122.09 g/mol
Exact Mass122.04
IUPAC Name2-fluoroethyl methyl carbonate
SMILESCOC(=O)OCCF
InChIInChI=1S/C4H7FO3/c1-7-4(6)8-3-2-5/h2-3H2,1H3
InChIKeyNOLGJZJMWUDWQW-UHFFFAOYSA-N
XLogP0.74
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 ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl methyl carbonate?
The IUPAC name of 2-fluoroethyl methyl carbonate (CID 53235554) is 2-fluoroethyl methyl carbonate.
What is the SMILES notation for 2-fluoroethyl methyl carbonate?
The canonical SMILES for 2-fluoroethyl methyl carbonate is COC(=O)OCCF.
What is the InChIKey of 2-fluoroethyl methyl carbonate?
The InChIKey is NOLGJZJMWUDWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7FO3/c1-7-4(6)8-3-2-5/h2-3H2,1H3.
What are the key properties of 2-fluoroethyl methyl carbonate?
2-fluoroethyl methyl carbonate has a molecular weight of 122.09 g/mol, XLogP of 0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl methyl carbonate is sourced from PubChem (CID 53235554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).