tetrakis(3-chlorobenzoic acid);bis(rhodium)

C28H20Cl4O8Rh2 — CID 11967271

IUPACtetrakis(3-chlorobenzoic acid);bis(rhodium)
SMILESO=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.[Rh].[Rh]
InChIInChI=1S/4C7H5ClO2.2Rh/c4*8-6-3-1-2-5(4-6)7(9)10;;/h4*1-4H,(H,9,10);;
InChIKeyFQSDBUVSKLUTDP-UHFFFAOYSA-N
MW832.08 g/mol
LogP8.15
Rot. Bonds4

About tetrakis(3-chlorobenzoic acid);bis(rhodium)

tetrakis(3-chlorobenzoic acid);bis(rhodium) (PubChem CID 11967271) has the molecular formula C28H20Cl4O8Rh2 and a molecular weight of 832.08 g/mol. Its IUPAC name is tetrakis(3-chlorobenzoic acid);bis(rhodium).

Molecular Properties

Compound Nametetrakis(3-chlorobenzoic acid);bis(rhodium)
PubChem CID11967271
Molecular FormulaC28H20Cl4O8Rh2
Molecular Weight832.08 g/mol
Exact Mass829.80
IUPAC Nametetrakis(3-chlorobenzoic acid);bis(rhodium)
SMILESO=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.[Rh].[Rh]
InChIInChI=1S/4C7H5ClO2.2Rh/c4*8-6-3-1-2-5(4-6)7(9)10;;/h4*1-4H,(H,9,10);;
InChIKeyFQSDBUVSKLUTDP-UHFFFAOYSA-N
XLogP8.15
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500832.08
LogP ≤ 58.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 139146863
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benzene-1,3-dicarboxylic acid;phosphane
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benzene-1,3-dicarboxylic acid;dichlorotitanium
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tris(benzene-1,3-dicarboxylic acid);terephthalic acid
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benzene-1,3-dicarboxylic acid;bis(oxovanadium)
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3,5-dichloro-4-[(3-chlorobenzoyl)amino]benzoic acid
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Frequently Asked Questions

What is the IUPAC name of tetrakis(3-chlorobenzoic acid);bis(rhodium)?
The IUPAC name of tetrakis(3-chlorobenzoic acid);bis(rhodium) (CID 11967271) is tetrakis(3-chlorobenzoic acid);bis(rhodium).
What is the SMILES notation for tetrakis(3-chlorobenzoic acid);bis(rhodium)?
The canonical SMILES for tetrakis(3-chlorobenzoic acid);bis(rhodium) is O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.O=C(O)c1cccc(Cl)c1.[Rh].[Rh].
What is the InChIKey of tetrakis(3-chlorobenzoic acid);bis(rhodium)?
The InChIKey is FQSDBUVSKLUTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/4C7H5ClO2.2Rh/c4*8-6-3-1-2-5(4-6)7(9)10;;/h4*1-4H,(H,9,10);;.
What are the key properties of tetrakis(3-chlorobenzoic acid);bis(rhodium)?
tetrakis(3-chlorobenzoic acid);bis(rhodium) has a molecular weight of 832.08 g/mol, XLogP of 8.15, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(3-chlorobenzoic acid);bis(rhodium) is sourced from PubChem (CID 11967271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).