2,2-difluoropent-4-enoic acid;silver

C5H6AgF2O2 — CID 59040077

IUPAC2,2-difluoropent-4-enoic acid;silver
SMILESC=CCC(F)(F)C(=O)O.[Ag]
InChIInChI=1S/C5H6F2O2.Ag/c1-2-3-5(6,7)4(8)9;/h2H,1,3H2,(H,8,9);
InChIKeySIWRCCOZGIUNBB-UHFFFAOYSA-N
MW243.96 g/mol
LogP1.28
Rot. Bonds3

About 2,2-difluoropent-4-enoic acid;silver

2,2-difluoropent-4-enoic acid;silver (PubChem CID 59040077) has the molecular formula C5H6AgF2O2 and a molecular weight of 243.96 g/mol. Its IUPAC name is 2,2-difluoropent-4-enoic acid;silver.

Molecular Properties

Compound Name2,2-difluoropent-4-enoic acid;silver
PubChem CID59040077
Molecular FormulaC5H6AgF2O2
Molecular Weight243.96 g/mol
Exact Mass242.94
IUPAC Name2,2-difluoropent-4-enoic acid;silver
SMILESC=CCC(F)(F)C(=O)O.[Ag]
InChIInChI=1S/C5H6F2O2.Ag/c1-2-3-5(6,7)4(8)9;/h2H,1,3H2,(H,8,9);
InChIKeySIWRCCOZGIUNBB-UHFFFAOYSA-N
XLogP1.28
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.96
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoropent-4-enoic acid;silver?
The IUPAC name of 2,2-difluoropent-4-enoic acid;silver (CID 59040077) is 2,2-difluoropent-4-enoic acid;silver.
What is the SMILES notation for 2,2-difluoropent-4-enoic acid;silver?
The canonical SMILES for 2,2-difluoropent-4-enoic acid;silver is C=CCC(F)(F)C(=O)O.[Ag].
What is the InChIKey of 2,2-difluoropent-4-enoic acid;silver?
The InChIKey is SIWRCCOZGIUNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F2O2.Ag/c1-2-3-5(6,7)4(8)9;/h2H,1,3H2,(H,8,9);.
What are the key properties of 2,2-difluoropent-4-enoic acid;silver?
2,2-difluoropent-4-enoic acid;silver has a molecular weight of 243.96 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoropent-4-enoic acid;silver is sourced from PubChem (CID 59040077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).