potassium;cyclohexylmethylphosphonic acid;hydride

C7H16KO3P — CID 173417626

IUPACpotassium;cyclohexylmethylphosphonic acid;hydride
SMILESO=P(O)(O)CC1CCCCC1.[H-].[K+]
InChIInChI=1S/C7H15O3P.K.H/c8-11(9,10)6-7-4-2-1-3-5-7;;/h7H,1-6H2,(H2,8,9,10);;/q;+1;-1
InChIKeyVLWTUNVHQLXJDZ-UHFFFAOYSA-N
MW218.27 g/mol
LogP-1.14
Rot. Bonds2

About potassium;cyclohexylmethylphosphonic acid;hydride

potassium;cyclohexylmethylphosphonic acid;hydride (PubChem CID 173417626) has the molecular formula C7H16KO3P and a molecular weight of 218.27 g/mol. Its IUPAC name is potassium;cyclohexylmethylphosphonic acid;hydride.

Molecular Properties

Compound Namepotassium;cyclohexylmethylphosphonic acid;hydride
PubChem CID173417626
Molecular FormulaC7H16KO3P
Molecular Weight218.27 g/mol
Exact Mass218.05
IUPAC Namepotassium;cyclohexylmethylphosphonic acid;hydride
SMILESO=P(O)(O)CC1CCCCC1.[H-].[K+]
InChIInChI=1S/C7H15O3P.K.H/c8-11(9,10)6-7-4-2-1-3-5-7;;/h7H,1-6H2,(H2,8,9,10);;/q;+1;-1
InChIKeyVLWTUNVHQLXJDZ-UHFFFAOYSA-N
XLogP-1.14
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cyclohexylmethylphosphonic acid;hydrate
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cyclohexylmethyl dihydrogen phosphate
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(cyclohexylmethylamino)phosphonic acid
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[cyclohexylmethyl(phenyl)phosphoryl]benzene
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potassium;2-cyclohexylacetic acid;hydride
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cyclopentylmethyl-[(2-methylpropan-2-yl)oxymethyl]phosphinic acid
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2-amino-2-[4-(phosphonomethyl)cyclohexyl]butanoic acid
CID 21299180
di(cyclooctyl)phosphinic acid
CID 15243623
(2R)-1-amino-3-[cyclohexylmethyl(methyl)phosphoryl]propan-2-ol
CID 59011201
cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid
CID 143150536
(1,1-dimethylpiperidin-1-ium-2-yl)methylphosphonic acid chloride
CID 67848323

Frequently Asked Questions

What is the IUPAC name of potassium;cyclohexylmethylphosphonic acid;hydride?
The IUPAC name of potassium;cyclohexylmethylphosphonic acid;hydride (CID 173417626) is potassium;cyclohexylmethylphosphonic acid;hydride.
What is the SMILES notation for potassium;cyclohexylmethylphosphonic acid;hydride?
The canonical SMILES for potassium;cyclohexylmethylphosphonic acid;hydride is O=P(O)(O)CC1CCCCC1.[H-].[K+].
What is the InChIKey of potassium;cyclohexylmethylphosphonic acid;hydride?
The InChIKey is VLWTUNVHQLXJDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15O3P.K.H/c8-11(9,10)6-7-4-2-1-3-5-7;;/h7H,1-6H2,(H2,8,9,10);;/q;+1;-1.
What are the key properties of potassium;cyclohexylmethylphosphonic acid;hydride?
potassium;cyclohexylmethylphosphonic acid;hydride has a molecular weight of 218.27 g/mol, XLogP of -1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;cyclohexylmethylphosphonic acid;hydride is sourced from PubChem (CID 173417626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).