1,3,5-trifluoropent-4-ene-1,2-diol

C5H7F3O2 — CID 175392518

IUPAC1,3,5-trifluoropent-4-ene-1,2-diol
SMILESOC(F)C(O)C(F)C=CF
InChIInChI=1S/C5H7F3O2/c6-2-1-3(7)4(9)5(8)10/h1-5,9-10H
InChIKeyWEYVLVNJAXZNFI-UHFFFAOYSA-N
MW156.10 g/mol
LogP0.46
Rot. Bonds3

About 1,3,5-trifluoropent-4-ene-1,2-diol

1,3,5-trifluoropent-4-ene-1,2-diol (PubChem CID 175392518) has the molecular formula C5H7F3O2 and a molecular weight of 156.10 g/mol. Its IUPAC name is 1,3,5-trifluoropent-4-ene-1,2-diol.

Molecular Properties

Compound Name1,3,5-trifluoropent-4-ene-1,2-diol
PubChem CID175392518
Molecular FormulaC5H7F3O2
Molecular Weight156.10 g/mol
Exact Mass156.04
IUPAC Name1,3,5-trifluoropent-4-ene-1,2-diol
SMILESOC(F)C(O)C(F)C=CF
InChIInChI=1S/C5H7F3O2/c6-2-1-3(7)4(9)5(8)10/h1-5,9-10H
InChIKeyWEYVLVNJAXZNFI-UHFFFAOYSA-N
XLogP0.46
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.10
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3,5-trifluoropent-4-ene-1,2-diol?
The IUPAC name of 1,3,5-trifluoropent-4-ene-1,2-diol (CID 175392518) is 1,3,5-trifluoropent-4-ene-1,2-diol.
What is the SMILES notation for 1,3,5-trifluoropent-4-ene-1,2-diol?
The canonical SMILES for 1,3,5-trifluoropent-4-ene-1,2-diol is OC(F)C(O)C(F)C=CF.
What is the InChIKey of 1,3,5-trifluoropent-4-ene-1,2-diol?
The InChIKey is WEYVLVNJAXZNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F3O2/c6-2-1-3(7)4(9)5(8)10/h1-5,9-10H.
What are the key properties of 1,3,5-trifluoropent-4-ene-1,2-diol?
1,3,5-trifluoropent-4-ene-1,2-diol has a molecular weight of 156.10 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trifluoropent-4-ene-1,2-diol is sourced from PubChem (CID 175392518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).