potassium propan-1-olate

C3H7KO — CID 23710234

IUPACpotassium propan-1-olate
SMILESCCC[O-].[K+]
InChIInChI=1S/C3H7O.K/c1-2-3-4;/h2-3H2,1H3;/q-1;+1
InChIKeyAWDMDDKZURRKFG-UHFFFAOYSA-N
MW98.19 g/mol
LogP-3.24
Rot. Bonds1

About potassium propan-1-olate

potassium propan-1-olate (PubChem CID 23710234) has the molecular formula C3H7KO and a molecular weight of 98.19 g/mol. Its IUPAC name is potassium propan-1-olate.

Molecular Properties

Compound Namepotassium propan-1-olate
PubChem CID23710234
Molecular FormulaC3H7KO
Molecular Weight98.19 g/mol
Exact Mass98.01
IUPAC Namepotassium propan-1-olate
SMILESCCC[O-].[K+]
InChIInChI=1S/C3H7O.K/c1-2-3-4;/h2-3H2,1H3;/q-1;+1
InChIKeyAWDMDDKZURRKFG-UHFFFAOYSA-N
XLogP-3.24
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.19
LogP ≤ 5-3.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Potassium ethoxide
CID 23670592
1-Propanol, sodium salt (1:1)
CID 23669363
Potassium propan-2-olate
CID 23663646
n-Propoxy radical
CID 140098
1-Propanol, ion(1-)
CID 12543515
Hypochlorous acid, propyl ester
CID 10986156
Brompropylate
CID 20226729
Lithium propoxide
CID 23694592
Propoxygermane
CID 87675468
CID 16684026
CID 16684026
Propyl hypofluorite
CID 21532307
Potassium 3-potassiopropoxide
CID 129687819

Frequently Asked Questions

What is the IUPAC name of potassium propan-1-olate?
The IUPAC name of potassium propan-1-olate (CID 23710234) is potassium propan-1-olate.
What is the SMILES notation for potassium propan-1-olate?
The canonical SMILES for potassium propan-1-olate is CCC[O-].[K+].
What is the InChIKey of potassium propan-1-olate?
The InChIKey is AWDMDDKZURRKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O.K/c1-2-3-4;/h2-3H2,1H3;/q-1;+1.
What are the key properties of potassium propan-1-olate?
potassium propan-1-olate has a molecular weight of 98.19 g/mol, XLogP of -3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium propan-1-olate is sourced from PubChem (CID 23710234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).