potassium;benzenethiol;hydride

C6H7KS — CID 173102690

IUPACpotassium;benzenethiol;hydride
SMILESSc1ccccc1.[H-].[K+]
InChIInChI=1S/C6H6S.K.H/c7-6-4-2-1-3-5-6;;/h1-5,7H;;/q;+1;-1
InChIKeyFVJQGWBPBJKJQN-UHFFFAOYSA-N
MW150.29 g/mol
LogP-0.91
Rot. Bonds

About potassium;benzenethiol;hydride

potassium;benzenethiol;hydride (PubChem CID 173102690) has the molecular formula C6H7KS and a molecular weight of 150.29 g/mol. Its IUPAC name is potassium;benzenethiol;hydride.

Molecular Properties

Compound Namepotassium;benzenethiol;hydride
PubChem CID173102690
Molecular FormulaC6H7KS
Molecular Weight150.29 g/mol
Exact Mass149.99
IUPAC Namepotassium;benzenethiol;hydride
SMILESSc1ccccc1.[H-].[K+]
InChIInChI=1S/C6H6S.K.H/c7-6-4-2-1-3-5-6;;/h1-5,7H;;/q;+1;-1
InChIKeyFVJQGWBPBJKJQN-UHFFFAOYSA-N
XLogP-0.91
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.29
LogP ≤ 5-0.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

Analyze potassium;benzenethiol;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

potassium benzenethiol
CID 21480154
magnesium;benzenethiol;hydride
CID 173349769
CID 175237801
CID 175237801
benzenethiol;palladium
CID 174858615
benzenethiol;methanamine
CID 174416805
benzenethiol;dioxotitanium
CID 174468726
benzenethiol;sulfur dioxide
CID 67056260
benzenethiol;chlorobenzene
CID 158473676
CID 172858912
CID 172858912
benzenethiol;butane;hydrate
CID 174869376
benzenethiol;ethane;4-methylbenzenethiol
CID 144560916
CID 21119592
CID 21119592

Frequently Asked Questions

What is the IUPAC name of potassium;benzenethiol;hydride?
The IUPAC name of potassium;benzenethiol;hydride (CID 173102690) is potassium;benzenethiol;hydride.
What is the SMILES notation for potassium;benzenethiol;hydride?
The canonical SMILES for potassium;benzenethiol;hydride is Sc1ccccc1.[H-].[K+].
What is the InChIKey of potassium;benzenethiol;hydride?
The InChIKey is FVJQGWBPBJKJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6S.K.H/c7-6-4-2-1-3-5-6;;/h1-5,7H;;/q;+1;-1.
What are the key properties of potassium;benzenethiol;hydride?
potassium;benzenethiol;hydride has a molecular weight of 150.29 g/mol, XLogP of -0.91, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;benzenethiol;hydride is sourced from PubChem (CID 173102690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).