benzene-1,3,5-tricarboxylic acid;europium;lanthanum

C9H6EuLaO6 — CID 174874160

IUPACbenzene-1,3,5-tricarboxylic acid;europium;lanthanum
SMILESO=C(O)c1cc(C(=O)O)cc(C(=O)O)c1.[Eu].[La]
InChIInChI=1S/C9H6O6.Eu.La/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;/h1-3H,(H,10,11)(H,12,13)(H,14,15);;
InChIKeyJHHYQAXTKXFDBQ-UHFFFAOYSA-N
MW501.01 g/mol
LogP0.78
Rot. Bonds3

About benzene-1,3,5-tricarboxylic acid;europium;lanthanum

benzene-1,3,5-tricarboxylic acid;europium;lanthanum (PubChem CID 174874160) has the molecular formula C9H6EuLaO6 and a molecular weight of 501.01 g/mol. Its IUPAC name is benzene-1,3,5-tricarboxylic acid;europium;lanthanum.

Molecular Properties

Compound Namebenzene-1,3,5-tricarboxylic acid;europium;lanthanum
PubChem CID174874160
Molecular FormulaC9H6EuLaO6
Molecular Weight501.01 g/mol
Exact Mass501.84
IUPAC Namebenzene-1,3,5-tricarboxylic acid;europium;lanthanum
SMILESO=C(O)c1cc(C(=O)O)cc(C(=O)O)c1.[Eu].[La]
InChIInChI=1S/C9H6O6.Eu.La/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;/h1-3H,(H,10,11)(H,12,13)(H,14,15);;
InChIKeyJHHYQAXTKXFDBQ-UHFFFAOYSA-N
XLogP0.78
TPSA111.90 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500501.01
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

benzene-1,3,5-tricarboxylic acid;europium
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benzene-1,3,5-tricarboxylic acid;vanadium
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tris(benzene-1,3,5-tricarboxylic acid);trihydrochloride
CID 66646410
benzene;benzene-1,3,5-tricarboxylic acid;carbonic acid
CID 174275338
barium(2+);benzene-1,3,5-tricarboxylic acid;hydride
CID 174613622
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CID 175461142
5-[3-[3,5-bis[3,5-bis(3,5-dicarboxyphenyl)phenyl]phenyl]-5-(3,5-dicarboxyphenyl)phenyl]benzene-1,3-dicarboxylic acid
CID 102363703
benzene;5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid
CID 175078023
3,5-dicarboxybenzoate
CID 5460728
benzene-1,3,5-tricarboxylic acid;3,4,5-trihydroxybenzoic acid
CID 174934845
5-tert-butylbenzene-1,3-dicarboxylic acid
CID 159495338

Frequently Asked Questions

What is the IUPAC name of benzene-1,3,5-tricarboxylic acid;europium;lanthanum?
The IUPAC name of benzene-1,3,5-tricarboxylic acid;europium;lanthanum (CID 174874160) is benzene-1,3,5-tricarboxylic acid;europium;lanthanum.
What is the SMILES notation for benzene-1,3,5-tricarboxylic acid;europium;lanthanum?
The canonical SMILES for benzene-1,3,5-tricarboxylic acid;europium;lanthanum is O=C(O)c1cc(C(=O)O)cc(C(=O)O)c1.[Eu].[La].
What is the InChIKey of benzene-1,3,5-tricarboxylic acid;europium;lanthanum?
The InChIKey is JHHYQAXTKXFDBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6O6.Eu.La/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;/h1-3H,(H,10,11)(H,12,13)(H,14,15);;.
What are the key properties of benzene-1,3,5-tricarboxylic acid;europium;lanthanum?
benzene-1,3,5-tricarboxylic acid;europium;lanthanum has a molecular weight of 501.01 g/mol, XLogP of 0.78, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,3,5-tricarboxylic acid;europium;lanthanum is sourced from PubChem (CID 174874160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).