(E)-2,3-difluorobut-2-en-1-ol

C4H6F2O — CID 14496002

IUPAC(E)-2,3-difluorobut-2-en-1-ol
SMILESC/C(F)=C(\F)CO
InChIInChI=1S/C4H6F2O/c1-3(5)4(6)2-7/h7H,2H2,1H3/b4-3+
InChIKeyXYWOWNUXAMPLGN-ONEGZZNKSA-N
MW108.09 g/mol
LogP1.15
Rot. Bonds1

About (E)-2,3-difluorobut-2-en-1-ol

(E)-2,3-difluorobut-2-en-1-ol (PubChem CID 14496002) has the molecular formula C4H6F2O and a molecular weight of 108.09 g/mol. Its IUPAC name is (E)-2,3-difluorobut-2-en-1-ol.

Molecular Properties

Compound Name(E)-2,3-difluorobut-2-en-1-ol
PubChem CID14496002
Molecular FormulaC4H6F2O
Molecular Weight108.09 g/mol
Exact Mass108.04
IUPAC Name(E)-2,3-difluorobut-2-en-1-ol
SMILESC/C(F)=C(\F)CO
InChIInChI=1S/C4H6F2O/c1-3(5)4(6)2-7/h7H,2H2,1H3/b4-3+
InChIKeyXYWOWNUXAMPLGN-ONEGZZNKSA-N
XLogP1.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.09
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-2,3-difluorobut-2-en-1-ol?
The IUPAC name of (E)-2,3-difluorobut-2-en-1-ol (CID 14496002) is (E)-2,3-difluorobut-2-en-1-ol.
What is the SMILES notation for (E)-2,3-difluorobut-2-en-1-ol?
The canonical SMILES for (E)-2,3-difluorobut-2-en-1-ol is C/C(F)=C(\F)CO.
What is the InChIKey of (E)-2,3-difluorobut-2-en-1-ol?
The InChIKey is XYWOWNUXAMPLGN-ONEGZZNKSA-N. The full InChI is InChI=1S/C4H6F2O/c1-3(5)4(6)2-7/h7H,2H2,1H3/b4-3+.
What are the key properties of (E)-2,3-difluorobut-2-en-1-ol?
(E)-2,3-difluorobut-2-en-1-ol has a molecular weight of 108.09 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,3-difluorobut-2-en-1-ol is sourced from PubChem (CID 14496002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).