2-methylpropan-1-olate;rubidium(1+)

C4H9ORb — CID 87530320

IUPAC2-methylpropan-1-olate;rubidium(1+)
SMILESCC(C)C[O-].[Rb+]
InChIInChI=1S/C4H9O.Rb/c1-4(2)3-5;/h4H,3H2,1-2H3;/q-1;+1
InChIKeyHVBKDFMUVZJIJA-UHFFFAOYSA-N
MW158.58 g/mol
LogP-2.99
Rot. Bonds1

About 2-methylpropan-1-olate;rubidium(1+)

2-methylpropan-1-olate;rubidium(1+) (PubChem CID 87530320) has the molecular formula C4H9ORb and a molecular weight of 158.58 g/mol. Its IUPAC name is 2-methylpropan-1-olate;rubidium(1+).

Molecular Properties

Compound Name2-methylpropan-1-olate;rubidium(1+)
PubChem CID87530320
Molecular FormulaC4H9ORb
Molecular Weight158.58 g/mol
Exact Mass157.98
IUPAC Name2-methylpropan-1-olate;rubidium(1+)
SMILESCC(C)C[O-].[Rb+]
InChIInChI=1S/C4H9O.Rb/c1-4(2)3-5;/h4H,3H2,1-2H3;/q-1;+1
InChIKeyHVBKDFMUVZJIJA-UHFFFAOYSA-N
XLogP-2.99
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.58
LogP ≤ 5-2.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-1-olate;rubidium(1+)?
The IUPAC name of 2-methylpropan-1-olate;rubidium(1+) (CID 87530320) is 2-methylpropan-1-olate;rubidium(1+).
What is the SMILES notation for 2-methylpropan-1-olate;rubidium(1+)?
The canonical SMILES for 2-methylpropan-1-olate;rubidium(1+) is CC(C)C[O-].[Rb+].
What is the InChIKey of 2-methylpropan-1-olate;rubidium(1+)?
The InChIKey is HVBKDFMUVZJIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9O.Rb/c1-4(2)3-5;/h4H,3H2,1-2H3;/q-1;+1.
What are the key properties of 2-methylpropan-1-olate;rubidium(1+)?
2-methylpropan-1-olate;rubidium(1+) has a molecular weight of 158.58 g/mol, XLogP of -2.99, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-1-olate;rubidium(1+) is sourced from PubChem (CID 87530320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).