butanoate;bis(rhodium(3+))

C24H42O12Rh2 — CID 173415846

IUPACbutanoate;bis(rhodium(3+))
SMILESCCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].[Rh+3].[Rh+3]
InChIInChI=1S/6C4H8O2.2Rh/c6*1-2-3-4(5)6;;/h6*2-3H2,1H3,(H,5,6);;/q;;;;;;2*+3/p-6
InChIKeyCOHAGMXICRBUAY-UHFFFAOYSA-H
MW728.40 g/mol
LogP-2.79
Rot. Bonds12

About butanoate;bis(rhodium(3+))

butanoate;bis(rhodium(3+)) (PubChem CID 173415846) has the molecular formula C24H42O12Rh2 and a molecular weight of 728.40 g/mol. Its IUPAC name is butanoate;bis(rhodium(3+)).

Molecular Properties

Compound Namebutanoate;bis(rhodium(3+))
PubChem CID173415846
Molecular FormulaC24H42O12Rh2
Molecular Weight728.40 g/mol
Exact Mass728.08
IUPAC Namebutanoate;bis(rhodium(3+))
SMILESCCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].[Rh+3].[Rh+3]
InChIInChI=1S/6C4H8O2.2Rh/c6*1-2-3-4(5)6;;/h6*2-3H2,1H3,(H,5,6);;/q;;;;;;2*+3/p-6
InChIKeyCOHAGMXICRBUAY-UHFFFAOYSA-H
XLogP-2.79
TPSA240.78 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500728.40
LogP ≤ 5-2.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Related Compounds

butanoate;ytterbium(2+)
CID 88777454
tetrapotassium;butanoate
CID 140982885
silver butanoate
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strontium butanoate
CID 19035288
butanoate;tin(4+)
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potassium butanoate
CID 23677461
magnesium butanoate
CID 6453218
disodium;butanoate;hydroxide
CID 173219323
butanoate;silicon(4+);titanium(4+)
CID 158800899
butanoate;titanium(2+);acetate
CID 87845450
butanoate;titanium(4+);acetate
CID 159866524
butanoate;carbanide;chromium(3+)
CID 158360920

Frequently Asked Questions

What is the IUPAC name of butanoate;bis(rhodium(3+))?
The IUPAC name of butanoate;bis(rhodium(3+)) (CID 173415846) is butanoate;bis(rhodium(3+)).
What is the SMILES notation for butanoate;bis(rhodium(3+))?
The canonical SMILES for butanoate;bis(rhodium(3+)) is CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].CCCC(=O)[O-].[Rh+3].[Rh+3].
What is the InChIKey of butanoate;bis(rhodium(3+))?
The InChIKey is COHAGMXICRBUAY-UHFFFAOYSA-H. The full InChI is InChI=1S/6C4H8O2.2Rh/c6*1-2-3-4(5)6;;/h6*2-3H2,1H3,(H,5,6);;/q;;;;;;2*+3/p-6.
What are the key properties of butanoate;bis(rhodium(3+))?
butanoate;bis(rhodium(3+)) has a molecular weight of 728.40 g/mol, XLogP of -2.79, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for butanoate;bis(rhodium(3+)) is sourced from PubChem (CID 173415846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).