5,5-difluoropent-4-en-2-ol

C5H8F2O — CID 12051374

IUPAC5,5-difluoropent-4-en-2-ol
SMILESCC(O)CC=C(F)F
InChIInChI=1S/C5H8F2O/c1-4(8)2-3-5(6)7/h3-4,8H,2H2,1H3
InChIKeyQPZMBQYPFJNTAK-UHFFFAOYSA-N
MW122.11 g/mol
LogP1.54
Rot. Bonds2

About 5,5-difluoropent-4-en-2-ol

5,5-difluoropent-4-en-2-ol (PubChem CID 12051374) has the molecular formula C5H8F2O and a molecular weight of 122.11 g/mol. Its IUPAC name is 5,5-difluoropent-4-en-2-ol.

Molecular Properties

Compound Name5,5-difluoropent-4-en-2-ol
PubChem CID12051374
Molecular FormulaC5H8F2O
Molecular Weight122.11 g/mol
Exact Mass122.05
IUPAC Name5,5-difluoropent-4-en-2-ol
SMILESCC(O)CC=C(F)F
InChIInChI=1S/C5H8F2O/c1-4(8)2-3-5(6)7/h3-4,8H,2H2,1H3
InChIKeyQPZMBQYPFJNTAK-UHFFFAOYSA-N
XLogP1.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.11
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,5-difluoropent-4-en-2-ol?
The IUPAC name of 5,5-difluoropent-4-en-2-ol (CID 12051374) is 5,5-difluoropent-4-en-2-ol.
What is the SMILES notation for 5,5-difluoropent-4-en-2-ol?
The canonical SMILES for 5,5-difluoropent-4-en-2-ol is CC(O)CC=C(F)F.
What is the InChIKey of 5,5-difluoropent-4-en-2-ol?
The InChIKey is QPZMBQYPFJNTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F2O/c1-4(8)2-3-5(6)7/h3-4,8H,2H2,1H3.
What are the key properties of 5,5-difluoropent-4-en-2-ol?
5,5-difluoropent-4-en-2-ol has a molecular weight of 122.11 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoropent-4-en-2-ol is sourced from PubChem (CID 12051374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).