potassium;acetic acid;boranuide

C2H8BKO2 — CID 173329515

IUPACpotassium;acetic acid;boranuide
SMILESCC(=O)O.[BH4-].[K+]
InChIInChI=1S/C2H4O2.BH4.K/c1-2(3)4;;/h1H3,(H,3,4);1H4;/q;-1;+1
InChIKeyZMNYFIKMNUGMTC-UHFFFAOYSA-N
MW113.99 g/mol
LogP-4.36
Rot. Bonds

About potassium;acetic acid;boranuide

potassium;acetic acid;boranuide (PubChem CID 173329515) has the molecular formula C2H8BKO2 and a molecular weight of 113.99 g/mol. Its IUPAC name is potassium;acetic acid;boranuide.

Molecular Properties

Compound Namepotassium;acetic acid;boranuide
PubChem CID173329515
Molecular FormulaC2H8BKO2
Molecular Weight113.99 g/mol
Exact Mass114.03
IUPAC Namepotassium;acetic acid;boranuide
SMILESCC(=O)O.[BH4-].[K+]
InChIInChI=1S/C2H4O2.BH4.K/c1-2(3)4;;/h1H3,(H,3,4);1H4;/q;-1;+1
InChIKeyZMNYFIKMNUGMTC-UHFFFAOYSA-N
XLogP-4.36
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.99
LogP ≤ 5-4.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

sodium;acetic acid;boranuide
CID 131724855
potassium;acetic acid;hydride
CID 173209804
acetic acid
CID 158444727
potassium;acetic acid;hydride;zinc
CID 174107253
potassium;acetic acid;hydride;hydrochloride
CID 173057386
acetic acid;palladium
CID 58759193
acetic acid;germane
CID 174334920
acetic acid;ruthenium
CID 175502908
acetic acid;vanadium
CID 173443465
acetic acid;stibane
CID 173054099
acetic acid;methanol
CID 173388753
acetic acid;ethane
CID 173226324

Frequently Asked Questions

What is the IUPAC name of potassium;acetic acid;boranuide?
The IUPAC name of potassium;acetic acid;boranuide (CID 173329515) is potassium;acetic acid;boranuide.
What is the SMILES notation for potassium;acetic acid;boranuide?
The canonical SMILES for potassium;acetic acid;boranuide is CC(=O)O.[BH4-].[K+].
What is the InChIKey of potassium;acetic acid;boranuide?
The InChIKey is ZMNYFIKMNUGMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.BH4.K/c1-2(3)4;;/h1H3,(H,3,4);1H4;/q;-1;+1.
What are the key properties of potassium;acetic acid;boranuide?
potassium;acetic acid;boranuide has a molecular weight of 113.99 g/mol, XLogP of -4.36, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;acetic acid;boranuide is sourced from PubChem (CID 173329515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).