1,4-dichlorobenzene;trichloroalumane

C6H4AlCl5 — CID 174756083

IUPAC1,4-dichlorobenzene;trichloroalumane
SMILESCl[Al](Cl)Cl.Clc1ccc(Cl)cc1
InChIInChI=1S/C6H4Cl2.Al.3ClH/c7-5-1-2-6(8)4-3-5;;;;/h1-4H;;3*1H/q;+3;;;/p-3
InChIKeyTXGIMOPTZDVJRU-UHFFFAOYSA-K
MW280.35 g/mol
LogP4.68
Rot. Bonds

About 1,4-dichlorobenzene;trichloroalumane

1,4-dichlorobenzene;trichloroalumane (PubChem CID 174756083) has the molecular formula C6H4AlCl5 and a molecular weight of 280.35 g/mol. Its IUPAC name is 1,4-dichlorobenzene;trichloroalumane.

Molecular Properties

Compound Name1,4-dichlorobenzene;trichloroalumane
PubChem CID174756083
Molecular FormulaC6H4AlCl5
Molecular Weight280.35 g/mol
Exact Mass277.86
IUPAC Name1,4-dichlorobenzene;trichloroalumane
SMILESCl[Al](Cl)Cl.Clc1ccc(Cl)cc1
InChIInChI=1S/C6H4Cl2.Al.3ClH/c7-5-1-2-6(8)4-3-5;;;;/h1-4H;;3*1H/q;+3;;;/p-3
InChIKeyTXGIMOPTZDVJRU-UHFFFAOYSA-K
XLogP4.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,4-dichlorobenzene;trichloroalumane?
The IUPAC name of 1,4-dichlorobenzene;trichloroalumane (CID 174756083) is 1,4-dichlorobenzene;trichloroalumane.
What is the SMILES notation for 1,4-dichlorobenzene;trichloroalumane?
The canonical SMILES for 1,4-dichlorobenzene;trichloroalumane is Cl[Al](Cl)Cl.Clc1ccc(Cl)cc1.
What is the InChIKey of 1,4-dichlorobenzene;trichloroalumane?
The InChIKey is TXGIMOPTZDVJRU-UHFFFAOYSA-K. The full InChI is InChI=1S/C6H4Cl2.Al.3ClH/c7-5-1-2-6(8)4-3-5;;;;/h1-4H;;3*1H/q;+3;;;/p-3.
What are the key properties of 1,4-dichlorobenzene;trichloroalumane?
1,4-dichlorobenzene;trichloroalumane has a molecular weight of 280.35 g/mol, XLogP of 4.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dichlorobenzene;trichloroalumane is sourced from PubChem (CID 174756083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).