aluminum toluene

C7H8Al+3 — CID 21283935

IUPACaluminum toluene
SMILESCc1ccccc1.[Al+3]
InChIInChI=1S/C7H8.Al/c1-7-5-3-2-4-6-7;/h2-6H,1H3;/q;+3
InChIKeyZTYQYLCVNSZEPV-UHFFFAOYSA-N
MW119.12 g/mol
LogP1.61
Rot. Bonds

About aluminum toluene

aluminum toluene (PubChem CID 21283935) has the molecular formula C7H8Al+3 and a molecular weight of 119.12 g/mol. Its IUPAC name is aluminum toluene.

Molecular Properties

Compound Namealuminum toluene
PubChem CID21283935
Molecular FormulaC7H8Al+3
Molecular Weight119.12 g/mol
Exact Mass119.04
IUPAC Namealuminum toluene
SMILESCc1ccccc1.[Al+3]
InChIInChI=1S/C7H8.Al/c1-7-5-3-2-4-6-7;/h2-6H,1H3;/q;+3
InChIKeyZTYQYLCVNSZEPV-UHFFFAOYSA-N
XLogP1.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.12
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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titanium(2+);toluene
CID 22023820
toluene;dihydrochloride
CID 66712893
iridium;toluene
CID 160574470
toluene;hydrate
CID 22272177
ethane;toluene
CID 91350799
toluene;tetrahydrochloride
CID 174345064
gold;toluene
CID 159315944
bismuthane;toluene
CID 173370039
germane;toluene
CID 174411556
benzene;ethane;toluene
CID 158929596

Frequently Asked Questions

What is the IUPAC name of aluminum toluene?
The IUPAC name of aluminum toluene (CID 21283935) is aluminum toluene.
What is the SMILES notation for aluminum toluene?
The canonical SMILES for aluminum toluene is Cc1ccccc1.[Al+3].
What is the InChIKey of aluminum toluene?
The InChIKey is ZTYQYLCVNSZEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.Al/c1-7-5-3-2-4-6-7;/h2-6H,1H3;/q;+3.
What are the key properties of aluminum toluene?
aluminum toluene has a molecular weight of 119.12 g/mol, XLogP of 1.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum toluene is sourced from PubChem (CID 21283935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).