potassium;carbonic acid;2-methylpropane

C5H11KO3 — CID 87220631

IUPACpotassium;carbonic acid;2-methylpropane
SMILESC[C-](C)C.O=C(O)O.[K+]
InChIInChI=1S/C4H9.CH2O3.K/c1-4(2)3;2-1(3)4;/h1-3H3;(H2,2,3,4);/q-1;;+1
InChIKeyFAVPQLYHPJYFIM-UHFFFAOYSA-N
MW158.24 g/mol
LogP-1.15
Rot. Bonds

About potassium;carbonic acid;2-methylpropane

potassium;carbonic acid;2-methylpropane (PubChem CID 87220631) has the molecular formula C5H11KO3 and a molecular weight of 158.24 g/mol. Its IUPAC name is potassium;carbonic acid;2-methylpropane.

Molecular Properties

Compound Namepotassium;carbonic acid;2-methylpropane
PubChem CID87220631
Molecular FormulaC5H11KO3
Molecular Weight158.24 g/mol
Exact Mass158.03
IUPAC Namepotassium;carbonic acid;2-methylpropane
SMILESC[C-](C)C.O=C(O)O.[K+]
InChIInChI=1S/C4H9.CH2O3.K/c1-4(2)3;2-1(3)4;/h1-3H3;(H2,2,3,4);/q-1;;+1
InChIKeyFAVPQLYHPJYFIM-UHFFFAOYSA-N
XLogP-1.15
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of potassium;carbonic acid;2-methylpropane?
The IUPAC name of potassium;carbonic acid;2-methylpropane (CID 87220631) is potassium;carbonic acid;2-methylpropane.
What is the SMILES notation for potassium;carbonic acid;2-methylpropane?
The canonical SMILES for potassium;carbonic acid;2-methylpropane is C[C-](C)C.O=C(O)O.[K+].
What is the InChIKey of potassium;carbonic acid;2-methylpropane?
The InChIKey is FAVPQLYHPJYFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9.CH2O3.K/c1-4(2)3;2-1(3)4;/h1-3H3;(H2,2,3,4);/q-1;;+1.
What are the key properties of potassium;carbonic acid;2-methylpropane?
potassium;carbonic acid;2-methylpropane has a molecular weight of 158.24 g/mol, XLogP of -1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;carbonic acid;2-methylpropane is sourced from PubChem (CID 87220631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).