cesium furan-2-carboxylate

C5H3CsO3 — CID 140900702

IUPACcesium furan-2-carboxylate
SMILESO=C([O-])c1ccco1.[Cs+]
InChIInChI=1S/C5H4O3.Cs/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1
InChIKeyCKFRRDULRPAXQT-UHFFFAOYSA-M
MW243.98 g/mol
LogP-3.35
Rot. Bonds1

About cesium furan-2-carboxylate

cesium furan-2-carboxylate (PubChem CID 140900702) has the molecular formula C5H3CsO3 and a molecular weight of 243.98 g/mol. Its IUPAC name is cesium furan-2-carboxylate.

Molecular Properties

Compound Namecesium furan-2-carboxylate
PubChem CID140900702
Molecular FormulaC5H3CsO3
Molecular Weight243.98 g/mol
Exact Mass243.91
IUPAC Namecesium furan-2-carboxylate
SMILESO=C([O-])c1ccco1.[Cs+]
InChIInChI=1S/C5H4O3.Cs/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1
InChIKeyCKFRRDULRPAXQT-UHFFFAOYSA-M
XLogP-3.35
TPSA53.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.98
LogP ≤ 5-3.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

sodium furan-2-carboxylate
CID 19205589
chromium(3+);tris(furan-2-carboxylate)
CID 158568014
calcium;bis(furan-2-carboxylate);hydrate
CID 160535503
copper;bis(furan-2-carboxylate);furan-2-carboxylic acid
CID 158113396
tris(dimethyl(methylsulfanyl)sulfanium);tris(furan-2-carboxylate)
CID 162078392
furan-2-carboxylic acid;silver
CID 87285311
furan-2-carboxylic acid;gold
CID 174701575
zinc furan-2-carboxylic acid
CID 25022579
furan-2-yl(phosphanyl)methanone
CID 151549332
bis(furan-2-carbothioic S-acid);hydrochloride
CID 122655797
Se-(furan-2-carbonylselanyl) furan-2-carboselenoate
CID 14909312
bis(furan-2-carbonyl)phosphanyl-(furan-2-yl)methanone
CID 18432898

Frequently Asked Questions

What is the IUPAC name of cesium furan-2-carboxylate?
The IUPAC name of cesium furan-2-carboxylate (CID 140900702) is cesium furan-2-carboxylate.
What is the SMILES notation for cesium furan-2-carboxylate?
The canonical SMILES for cesium furan-2-carboxylate is O=C([O-])c1ccco1.[Cs+].
What is the InChIKey of cesium furan-2-carboxylate?
The InChIKey is CKFRRDULRPAXQT-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H4O3.Cs/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1.
What are the key properties of cesium furan-2-carboxylate?
cesium furan-2-carboxylate has a molecular weight of 243.98 g/mol, XLogP of -3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cesium furan-2-carboxylate is sourced from PubChem (CID 140900702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).