potassium;carbonic acid;2-methanidyloxirane

C4H7KO4 — CID 88512362

IUPACpotassium;carbonic acid;2-methanidyloxirane
SMILESO=C(O)O.[CH2-]C1CO1.[K+]
InChIInChI=1S/C3H5O.CH2O3.K/c1-3-2-4-3;2-1(3)4;/h3H,1-2H2;(H2,2,3,4);/q-1;;+1
InChIKeySGRKNODHGSOMCT-UHFFFAOYSA-N
MW158.19 g/mol
LogP-2.55
Rot. Bonds

About potassium;carbonic acid;2-methanidyloxirane

potassium;carbonic acid;2-methanidyloxirane (PubChem CID 88512362) has the molecular formula C4H7KO4 and a molecular weight of 158.19 g/mol. Its IUPAC name is potassium;carbonic acid;2-methanidyloxirane.

Molecular Properties

Compound Namepotassium;carbonic acid;2-methanidyloxirane
PubChem CID88512362
Molecular FormulaC4H7KO4
Molecular Weight158.19 g/mol
Exact Mass158.00
IUPAC Namepotassium;carbonic acid;2-methanidyloxirane
SMILESO=C(O)O.[CH2-]C1CO1.[K+]
InChIInChI=1S/C3H5O.CH2O3.K/c1-3-2-4-3;2-1(3)4;/h3H,1-2H2;(H2,2,3,4);/q-1;;+1
InChIKeySGRKNODHGSOMCT-UHFFFAOYSA-N
XLogP-2.55
TPSA70.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.19
LogP ≤ 5-2.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;carbonic acid;2-methanidyloxirane?
The IUPAC name of potassium;carbonic acid;2-methanidyloxirane (CID 88512362) is potassium;carbonic acid;2-methanidyloxirane.
What is the SMILES notation for potassium;carbonic acid;2-methanidyloxirane?
The canonical SMILES for potassium;carbonic acid;2-methanidyloxirane is O=C(O)O.[CH2-]C1CO1.[K+].
What is the InChIKey of potassium;carbonic acid;2-methanidyloxirane?
The InChIKey is SGRKNODHGSOMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5O.CH2O3.K/c1-3-2-4-3;2-1(3)4;/h3H,1-2H2;(H2,2,3,4);/q-1;;+1.
What are the key properties of potassium;carbonic acid;2-methanidyloxirane?
potassium;carbonic acid;2-methanidyloxirane has a molecular weight of 158.19 g/mol, XLogP of -2.55, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;carbonic acid;2-methanidyloxirane is sourced from PubChem (CID 88512362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).