potassium 2-cyclopropylethanolate

C5H9KO — CID 143714530

IUPACpotassium 2-cyclopropylethanolate
SMILES[K+].[O-]CCC1CC1
InChIInChI=1S/C5H9O.K/c6-4-3-5-1-2-5;/h5H,1-4H2;/q-1;+1
InChIKeyQYJASBMTOZGZMQ-UHFFFAOYSA-N
MW124.22 g/mol
LogP-2.85
Rot. Bonds2

About potassium 2-cyclopropylethanolate

potassium 2-cyclopropylethanolate (PubChem CID 143714530) has the molecular formula C5H9KO and a molecular weight of 124.22 g/mol. Its IUPAC name is potassium 2-cyclopropylethanolate.

Molecular Properties

Compound Namepotassium 2-cyclopropylethanolate
PubChem CID143714530
Molecular FormulaC5H9KO
Molecular Weight124.22 g/mol
Exact Mass124.03
IUPAC Namepotassium 2-cyclopropylethanolate
SMILES[K+].[O-]CCC1CC1
InChIInChI=1S/C5H9O.K/c6-4-3-5-1-2-5;/h5H,1-4H2;/q-1;+1
InChIKeyQYJASBMTOZGZMQ-UHFFFAOYSA-N
XLogP-2.85
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.22
LogP ≤ 5-2.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 20798615
CID 59234222
CID 59234222
CID 89367149
CID 89367149
CID 89534826
CID 89534826
CID 117694673
CID 117694673
CID 155612893
CID 155612893
CID 172781000
CID 172781000
CID 177049496
CID 177049496
CID 178712017
CID 178712017

Frequently Asked Questions

What is the IUPAC name of potassium 2-cyclopropylethanolate?
The IUPAC name of potassium 2-cyclopropylethanolate (CID 143714530) is potassium 2-cyclopropylethanolate.
What is the SMILES notation for potassium 2-cyclopropylethanolate?
The canonical SMILES for potassium 2-cyclopropylethanolate is [K+].[O-]CCC1CC1.
What is the InChIKey of potassium 2-cyclopropylethanolate?
The InChIKey is QYJASBMTOZGZMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9O.K/c6-4-3-5-1-2-5;/h5H,1-4H2;/q-1;+1.
What are the key properties of potassium 2-cyclopropylethanolate?
potassium 2-cyclopropylethanolate has a molecular weight of 124.22 g/mol, XLogP of -2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-cyclopropylethanolate is sourced from PubChem (CID 143714530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).