potassium cyclohexen-1-olate

C6H9KO — CID 23700298

IUPACpotassium cyclohexen-1-olate
SMILES[K+].[O-]C1=CCCCC1
InChIInChI=1S/C6H10O.K/c7-6-4-2-1-3-5-6;/h4,7H,1-3,5H2;/q;+1/p-1
InChIKeyBJRPYNGPFAUWDJ-UHFFFAOYSA-M
MW136.24 g/mol
LogP-2.19
Rot. Bonds

About potassium cyclohexen-1-olate

potassium cyclohexen-1-olate (PubChem CID 23700298) has the molecular formula C6H9KO and a molecular weight of 136.24 g/mol. Its IUPAC name is potassium cyclohexen-1-olate.

Molecular Properties

Compound Namepotassium cyclohexen-1-olate
PubChem CID23700298
Molecular FormulaC6H9KO
Molecular Weight136.24 g/mol
Exact Mass136.03
IUPAC Namepotassium cyclohexen-1-olate
SMILES[K+].[O-]C1=CCCCC1
InChIInChI=1S/C6H10O.K/c7-6-4-2-1-3-5-6;/h4,7H,1-3,5H2;/q;+1/p-1
InChIKeyBJRPYNGPFAUWDJ-UHFFFAOYSA-M
XLogP-2.19
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 5-2.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of potassium cyclohexen-1-olate?
The IUPAC name of potassium cyclohexen-1-olate (CID 23700298) is potassium cyclohexen-1-olate.
What is the SMILES notation for potassium cyclohexen-1-olate?
The canonical SMILES for potassium cyclohexen-1-olate is [K+].[O-]C1=CCCCC1.
What is the InChIKey of potassium cyclohexen-1-olate?
The InChIKey is BJRPYNGPFAUWDJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H10O.K/c7-6-4-2-1-3-5-6;/h4,7H,1-3,5H2;/q;+1/p-1.
What are the key properties of potassium cyclohexen-1-olate?
potassium cyclohexen-1-olate has a molecular weight of 136.24 g/mol, XLogP of -2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium cyclohexen-1-olate is sourced from PubChem (CID 23700298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).