bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)

C44H36N4O16Rh2 — CID 139247274

IUPACbis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)
SMILESCC(C(=O)O)N1C(=O)c2ccccc2C1=O.CC(C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.[Rh].[Rh]
InChIInChI=1S/4C11H9NO4.2Rh/c4*1-6(11(15)16)12-9(13)7-4-2-3-5-8(7)10(12)14;;/h4*2-6H,1H3,(H,15,16);;/t2*6-;;;;/m00..../s1
InChIKeyCOOJQUSZWRHPEJ-VEEDJJOCSA-N
MW1082.60 g/mol
LogP3.02
Rot. Bonds8

About bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)

bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium) (PubChem CID 139247274) has the molecular formula C44H36N4O16Rh2 and a molecular weight of 1082.60 g/mol. Its IUPAC name is bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium).

Molecular Properties

Compound Namebis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)
PubChem CID139247274
Molecular FormulaC44H36N4O16Rh2
Molecular Weight1082.60 g/mol
Exact Mass1082.02
IUPAC Namebis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)
SMILESCC(C(=O)O)N1C(=O)c2ccccc2C1=O.CC(C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.[Rh].[Rh]
InChIInChI=1S/4C11H9NO4.2Rh/c4*1-6(11(15)16)12-9(13)7-4-2-3-5-8(7)10(12)14;;/h4*2-6H,1H3,(H,15,16);;/t2*6-;;;;/m00..../s1
InChIKeyCOOJQUSZWRHPEJ-VEEDJJOCSA-N
XLogP3.02
TPSA298.72 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds8
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001082.60
LogP ≤ 53.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)?
The IUPAC name of bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium) (CID 139247274) is bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium).
What is the SMILES notation for bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)?
The canonical SMILES for bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium) is CC(C(=O)O)N1C(=O)c2ccccc2C1=O.CC(C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.C[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O.[Rh].[Rh].
What is the InChIKey of bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)?
The InChIKey is COOJQUSZWRHPEJ-VEEDJJOCSA-N. The full InChI is InChI=1S/4C11H9NO4.2Rh/c4*1-6(11(15)16)12-9(13)7-4-2-3-5-8(7)10(12)14;;/h4*2-6H,1H3,(H,15,16);;/t2*6-;;;;/m00..../s1.
What are the key properties of bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium)?
bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium) has a molecular weight of 1082.60 g/mol, XLogP of 3.02, 8 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis((2S)-2-(1,3-dioxoisoindol-2-yl)propanoic acid);bis(rhodium) is sourced from PubChem (CID 139247274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).