potassium;1,2,3-trimethylbenzene;chloride

C9H12ClK — CID 174813799

IUPACpotassium;1,2,3-trimethylbenzene;chloride
SMILESCc1cccc(C)c1C.[Cl-].[K+]
InChIInChI=1S/C9H12.ClH.K/c1-7-5-4-6-8(2)9(7)3;;/h4-6H,1-3H3;1H;/q;;+1/p-1
InChIKeyXSKBYVNYXAJMEL-UHFFFAOYSA-M
MW194.75 g/mol
LogP-3.38
Rot. Bonds

About potassium;1,2,3-trimethylbenzene;chloride

potassium;1,2,3-trimethylbenzene;chloride (PubChem CID 174813799) has the molecular formula C9H12ClK and a molecular weight of 194.75 g/mol. Its IUPAC name is potassium;1,2,3-trimethylbenzene;chloride.

Molecular Properties

Compound Namepotassium;1,2,3-trimethylbenzene;chloride
PubChem CID174813799
Molecular FormulaC9H12ClK
Molecular Weight194.75 g/mol
Exact Mass194.03
IUPAC Namepotassium;1,2,3-trimethylbenzene;chloride
SMILESCc1cccc(C)c1C.[Cl-].[K+]
InChIInChI=1S/C9H12.ClH.K/c1-7-5-4-6-8(2)9(7)3;;/h4-6H,1-3H3;1H;/q;;+1/p-1
InChIKeyXSKBYVNYXAJMEL-UHFFFAOYSA-M
XLogP-3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.75
LogP ≤ 5-3.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

benzene;1,2,3-trimethylbenzene
CID 159605245
ethane;1,2,3-trimethylbenzene
CID 54068667
1,2,4,5-tetramethylbenzene;1,2,3-trimethylbenzene
CID 158486906
methane;1,2,3-trimethylbenzene;1,2-xylene
CID 157250417
dichlororuthenium;1,2,3-trimethylbenzene
CID 87163409
methylsulfinylmethane;1,2,3-trimethylbenzene
CID 174947389
pyridine;1,2,3-trimethylbenzene;hydrochloride
CID 174567082
phosphoric acid;tris(1,2,3-trimethylbenzene)
CID 175926272
phosphenous acid;1,2,3-trimethylbenzene
CID 174913168
bis(2,3-dimethylphenol);zirconium(2+);dichloride
CID 174478108
hexane;1,2,3-trimethylbenzene
CID 159405289
1-[(Z)-2-(2,3-dimethylphenyl)ethenyl]-2,3-dimethylbenzene
CID 135028757

Frequently Asked Questions

What is the IUPAC name of potassium;1,2,3-trimethylbenzene;chloride?
The IUPAC name of potassium;1,2,3-trimethylbenzene;chloride (CID 174813799) is potassium;1,2,3-trimethylbenzene;chloride.
What is the SMILES notation for potassium;1,2,3-trimethylbenzene;chloride?
The canonical SMILES for potassium;1,2,3-trimethylbenzene;chloride is Cc1cccc(C)c1C.[Cl-].[K+].
What is the InChIKey of potassium;1,2,3-trimethylbenzene;chloride?
The InChIKey is XSKBYVNYXAJMEL-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H12.ClH.K/c1-7-5-4-6-8(2)9(7)3;;/h4-6H,1-3H3;1H;/q;;+1/p-1.
What are the key properties of potassium;1,2,3-trimethylbenzene;chloride?
potassium;1,2,3-trimethylbenzene;chloride has a molecular weight of 194.75 g/mol, XLogP of -3.38, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1,2,3-trimethylbenzene;chloride is sourced from PubChem (CID 174813799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).