potassium;buta-1,3-diene;hydride

C4H7K — CID 173344451

IUPACpotassium;buta-1,3-diene;hydride
SMILESC=CC=C.[H-].[K+]
InChIInChI=1S/C4H6.K.H/c1-3-4-2;;/h3-4H,1-2H2;;/q;+1;-1
InChIKeyZMHBSEPQWSDUTL-UHFFFAOYSA-N
MW94.20 g/mol
LogP-1.53
Rot. Bonds1

About potassium;buta-1,3-diene;hydride

potassium;buta-1,3-diene;hydride (PubChem CID 173344451) has the molecular formula C4H7K and a molecular weight of 94.20 g/mol. Its IUPAC name is potassium;buta-1,3-diene;hydride.

Molecular Properties

Compound Namepotassium;buta-1,3-diene;hydride
PubChem CID173344451
Molecular FormulaC4H7K
Molecular Weight94.20 g/mol
Exact Mass94.02
IUPAC Namepotassium;buta-1,3-diene;hydride
SMILESC=CC=C.[H-].[K+]
InChIInChI=1S/C4H6.K.H/c1-3-4-2;;/h3-4H,1-2H2;;/q;+1;-1
InChIKeyZMHBSEPQWSDUTL-UHFFFAOYSA-N
XLogP-1.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.20
LogP ≤ 5-1.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

magnesium;buta-1,3-diene;hydride
CID 173132435
buta-1,3-diene
CID 7845
lithium;buta-1,3-diene;hydride;titanium
CID 173312830
buta-1,3-diene;hydrochloride
CID 22994657
buta-1,3-diene;sulfanide
CID 19865721
buta-1,3-diene;niobium
CID 159648114
magnesium buta-1,3-diene
CID 12825333
CID 158304462
CID 158304462
buta-1,3-diene;zirconium
CID 173105589
buta-1,3-diene;iron
CID 162166564
buta-1,3-diene;methane;uranium
CID 159390799
buta-1,3-diene;hydrazine
CID 159339609

Frequently Asked Questions

What is the IUPAC name of potassium;buta-1,3-diene;hydride?
The IUPAC name of potassium;buta-1,3-diene;hydride (CID 173344451) is potassium;buta-1,3-diene;hydride.
What is the SMILES notation for potassium;buta-1,3-diene;hydride?
The canonical SMILES for potassium;buta-1,3-diene;hydride is C=CC=C.[H-].[K+].
What is the InChIKey of potassium;buta-1,3-diene;hydride?
The InChIKey is ZMHBSEPQWSDUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6.K.H/c1-3-4-2;;/h3-4H,1-2H2;;/q;+1;-1.
What are the key properties of potassium;buta-1,3-diene;hydride?
potassium;buta-1,3-diene;hydride has a molecular weight of 94.20 g/mol, XLogP of -1.53, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;buta-1,3-diene;hydride is sourced from PubChem (CID 173344451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).