potassium;2-anilinoethanol;sulfuric acid;hydroxide

C8H14KNO6S — CID 67587133

IUPACpotassium;2-anilinoethanol;sulfuric acid;hydroxide
SMILESO=S(=O)(O)O.OCCNc1ccccc1.[K+].[OH-]
InChIInChI=1S/C8H11NO.K.H2O4S.H2O/c10-7-6-9-8-4-2-1-3-5-8;;1-5(2,3)4;/h1-5,9-10H,6-7H2;;(H2,1,2,3,4);1H2/q;+1;;/p-1
InChIKeyYVDUHNARNZZEPI-UHFFFAOYSA-M
MW291.37 g/mol
LogP-2.73
Rot. Bonds3

About potassium;2-anilinoethanol;sulfuric acid;hydroxide

potassium;2-anilinoethanol;sulfuric acid;hydroxide (PubChem CID 67587133) has the molecular formula C8H14KNO6S and a molecular weight of 291.37 g/mol. Its IUPAC name is potassium;2-anilinoethanol;sulfuric acid;hydroxide.

Molecular Properties

Compound Namepotassium;2-anilinoethanol;sulfuric acid;hydroxide
PubChem CID67587133
Molecular FormulaC8H14KNO6S
Molecular Weight291.37 g/mol
Exact Mass291.02
IUPAC Namepotassium;2-anilinoethanol;sulfuric acid;hydroxide
SMILESO=S(=O)(O)O.OCCNc1ccccc1.[K+].[OH-]
InChIInChI=1S/C8H11NO.K.H2O4S.H2O/c10-7-6-9-8-4-2-1-3-5-8;;1-5(2,3)4;/h1-5,9-10H,6-7H2;;(H2,1,2,3,4);1H2/q;+1;;/p-1
InChIKeyYVDUHNARNZZEPI-UHFFFAOYSA-M
XLogP-2.73
TPSA136.86 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 5-2.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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CID 67927731
2-anilinoethanol;dichlorocopper
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10-anilinodecan-1-ol
CID 10955954
bis(N-ethylaniline);sulfuric acid
CID 172710683
bis(N-ethylaniline);sulfuric acid;dihydrate
CID 172803236
2-(4-benzylanilino)ethanol
CID 91561467
3-anilinopropan-1-ol;phosphoric acid
CID 66984453
N-phenylaniline;sulfuric acid
CID 11486
2-(2-hydroxyethylamino)benzenesulfonic acid
CID 20512895
N-(5-anilinopentyl)-2-methylpropane-2-sulfonamide
CID 70939729
N,N'-diphenylmethanediamine;ethane-1,2-diol
CID 160711297

Frequently Asked Questions

What is the IUPAC name of potassium;2-anilinoethanol;sulfuric acid;hydroxide?
The IUPAC name of potassium;2-anilinoethanol;sulfuric acid;hydroxide (CID 67587133) is potassium;2-anilinoethanol;sulfuric acid;hydroxide.
What is the SMILES notation for potassium;2-anilinoethanol;sulfuric acid;hydroxide?
The canonical SMILES for potassium;2-anilinoethanol;sulfuric acid;hydroxide is O=S(=O)(O)O.OCCNc1ccccc1.[K+].[OH-].
What is the InChIKey of potassium;2-anilinoethanol;sulfuric acid;hydroxide?
The InChIKey is YVDUHNARNZZEPI-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H11NO.K.H2O4S.H2O/c10-7-6-9-8-4-2-1-3-5-8;;1-5(2,3)4;/h1-5,9-10H,6-7H2;;(H2,1,2,3,4);1H2/q;+1;;/p-1.
What are the key properties of potassium;2-anilinoethanol;sulfuric acid;hydroxide?
potassium;2-anilinoethanol;sulfuric acid;hydroxide has a molecular weight of 291.37 g/mol, XLogP of -2.73, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-anilinoethanol;sulfuric acid;hydroxide is sourced from PubChem (CID 67587133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).