aluminum;ethene;trichloride

C4H8AlCl3 — CID 160515090

IUPACaluminum;ethene;trichloride
SMILESC=C.C=C.[Al+3].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/2C2H4.Al.3ClH/c2*1-2;;;;/h2*1-2H2;;3*1H/q;;+3;;;/p-3
InChIKeyQTNWFAYYWJULCV-UHFFFAOYSA-K
MW189.45 g/mol
LogP-7.76
Rot. Bonds

About aluminum;ethene;trichloride

aluminum;ethene;trichloride (PubChem CID 160515090) has the molecular formula C4H8AlCl3 and a molecular weight of 189.45 g/mol. Its IUPAC name is aluminum;ethene;trichloride.

Molecular Properties

Compound Namealuminum;ethene;trichloride
PubChem CID160515090
Molecular FormulaC4H8AlCl3
Molecular Weight189.45 g/mol
Exact Mass187.95
IUPAC Namealuminum;ethene;trichloride
SMILESC=C.C=C.[Al+3].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/2C2H4.Al.3ClH/c2*1-2;;;;/h2*1-2H2;;3*1H/q;;+3;;;/p-3
InChIKeyQTNWFAYYWJULCV-UHFFFAOYSA-K
XLogP-7.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.45
LogP ≤ 5-7.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethene;trichloride
CID 23135135
aluminum ethene
CID 19428777
calcium;ethene;trichloride
CID 21413632
azane;ethene
CID 22734726
ethene;sulfane
CID 173042161
aluminum;carbanide;dichloride
CID 10154027
aluminum;copper(1+);chloride
CID 21470388
ethene;methane
CID 158775947
azane;ethene
CID 172863164
dialuminum;bromide;chloride
CID 19843700
ethene;neon
CID 159102047
antimony(3+);ethene
CID 22289936

Frequently Asked Questions

What is the IUPAC name of aluminum;ethene;trichloride?
The IUPAC name of aluminum;ethene;trichloride (CID 160515090) is aluminum;ethene;trichloride.
What is the SMILES notation for aluminum;ethene;trichloride?
The canonical SMILES for aluminum;ethene;trichloride is C=C.C=C.[Al+3].[Cl-].[Cl-].[Cl-].
What is the InChIKey of aluminum;ethene;trichloride?
The InChIKey is QTNWFAYYWJULCV-UHFFFAOYSA-K. The full InChI is InChI=1S/2C2H4.Al.3ClH/c2*1-2;;;;/h2*1-2H2;;3*1H/q;;+3;;;/p-3.
What are the key properties of aluminum;ethene;trichloride?
aluminum;ethene;trichloride has a molecular weight of 189.45 g/mol, XLogP of -7.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;ethene;trichloride is sourced from PubChem (CID 160515090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).