tetrakis(2,2-dimethylpropanoic acid);molybdenum

C20H40MoO8 — CID 171378141

IUPACtetrakis(2,2-dimethylpropanoic acid);molybdenum
SMILESCC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.[Mo]
InChIInChI=1S/4C5H10O2.Mo/c4*1-5(2,3)4(6)7;/h4*1-3H3,(H,6,7);
InChIKeyRXYAXTHTOXKFNF-UHFFFAOYSA-N
MW504.47 g/mol
LogP4.47
Rot. Bonds

About tetrakis(2,2-dimethylpropanoic acid);molybdenum

tetrakis(2,2-dimethylpropanoic acid);molybdenum (PubChem CID 171378141) has the molecular formula C20H40MoO8 and a molecular weight of 504.47 g/mol. Its IUPAC name is tetrakis(2,2-dimethylpropanoic acid);molybdenum.

Molecular Properties

Compound Nametetrakis(2,2-dimethylpropanoic acid);molybdenum
PubChem CID171378141
Molecular FormulaC20H40MoO8
Molecular Weight504.47 g/mol
Exact Mass506.18
IUPAC Nametetrakis(2,2-dimethylpropanoic acid);molybdenum
SMILESCC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.[Mo]
InChIInChI=1S/4C5H10O2.Mo/c4*1-5(2,3)4(6)7;/h4*1-3H3,(H,6,7);
InChIKeyRXYAXTHTOXKFNF-UHFFFAOYSA-N
XLogP4.47
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500504.47
LogP ≤ 54.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tetrakis(2,2-dimethylpropanoic acid);molybdenum?
The IUPAC name of tetrakis(2,2-dimethylpropanoic acid);molybdenum (CID 171378141) is tetrakis(2,2-dimethylpropanoic acid);molybdenum.
What is the SMILES notation for tetrakis(2,2-dimethylpropanoic acid);molybdenum?
The canonical SMILES for tetrakis(2,2-dimethylpropanoic acid);molybdenum is CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.[Mo].
What is the InChIKey of tetrakis(2,2-dimethylpropanoic acid);molybdenum?
The InChIKey is RXYAXTHTOXKFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/4C5H10O2.Mo/c4*1-5(2,3)4(6)7;/h4*1-3H3,(H,6,7);.
What are the key properties of tetrakis(2,2-dimethylpropanoic acid);molybdenum?
tetrakis(2,2-dimethylpropanoic acid);molybdenum has a molecular weight of 504.47 g/mol, XLogP of 4.47, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2,2-dimethylpropanoic acid);molybdenum is sourced from PubChem (CID 171378141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).