bis(propan-2-olate);samarium

C6H14O2Sm-2 — CID 162338231

IUPACbis(propan-2-olate);samarium
SMILESCC(C)[O-].CC(C)[O-].[Sm]
InChIInChI=1S/2C3H7O.Sm/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;
InChIKeyLGPQGNGCFYGRTF-UHFFFAOYSA-N
MW268.54 g/mol
LogP-0.49
Rot. Bonds

About bis(propan-2-olate);samarium

bis(propan-2-olate);samarium (PubChem CID 162338231) has the molecular formula C6H14O2Sm-2 and a molecular weight of 268.54 g/mol. Its IUPAC name is bis(propan-2-olate);samarium.

Molecular Properties

Compound Namebis(propan-2-olate);samarium
PubChem CID162338231
Molecular FormulaC6H14O2Sm-2
Molecular Weight268.54 g/mol
Exact Mass270.02
IUPAC Namebis(propan-2-olate);samarium
SMILESCC(C)[O-].CC(C)[O-].[Sm]
InChIInChI=1S/2C3H7O.Sm/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;
InChIKeyLGPQGNGCFYGRTF-UHFFFAOYSA-N
XLogP-0.49
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.54
LogP ≤ 5-0.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of bis(propan-2-olate);samarium?
The IUPAC name of bis(propan-2-olate);samarium (CID 162338231) is bis(propan-2-olate);samarium.
What is the SMILES notation for bis(propan-2-olate);samarium?
The canonical SMILES for bis(propan-2-olate);samarium is CC(C)[O-].CC(C)[O-].[Sm].
What is the InChIKey of bis(propan-2-olate);samarium?
The InChIKey is LGPQGNGCFYGRTF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7O.Sm/c2*1-3(2)4;/h2*3H,1-2H3;/q2*-1;.
What are the key properties of bis(propan-2-olate);samarium?
bis(propan-2-olate);samarium has a molecular weight of 268.54 g/mol, XLogP of -0.49, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(propan-2-olate);samarium is sourced from PubChem (CID 162338231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).