4-methylpentylaluminum(2+) dichloride

C6H13AlCl2 — CID 20516771

IUPAC4-methylpentylaluminum(2+) dichloride
SMILESCC(C)CCC[Al+2].[Cl-].[Cl-]
InChIInChI=1S/C6H13.Al.2ClH/c1-4-5-6(2)3;;;/h6H,1,4-5H2,2-3H3;;2*1H/q;+2;;/p-2
InChIKeyXRLPWAWAJCCSPO-UHFFFAOYSA-L
MW183.06 g/mol
LogP-3.98
Rot. Bonds3

About 4-methylpentylaluminum(2+) dichloride

4-methylpentylaluminum(2+) dichloride (PubChem CID 20516771) has the molecular formula C6H13AlCl2 and a molecular weight of 183.06 g/mol. Its IUPAC name is 4-methylpentylaluminum(2+) dichloride.

Molecular Properties

Compound Name4-methylpentylaluminum(2+) dichloride
PubChem CID20516771
Molecular FormulaC6H13AlCl2
Molecular Weight183.06 g/mol
Exact Mass182.02
IUPAC Name4-methylpentylaluminum(2+) dichloride
SMILESCC(C)CCC[Al+2].[Cl-].[Cl-]
InChIInChI=1S/C6H13.Al.2ClH/c1-4-5-6(2)3;;;/h6H,1,4-5H2,2-3H3;;2*1H/q;+2;;/p-2
InChIKeyXRLPWAWAJCCSPO-UHFFFAOYSA-L
XLogP-3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.06
LogP ≤ 5-3.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,9-dimethyldecane;2,11-dimethyldodecane;2,8-dimethylnonane;2,7-dimethyloctane;2,10-dimethylundecane
CID 161261647
2,22-dimethyltricosane
CID 58100191
tris(2,7-dimethyloctane);ethane;methane
CID 159869544
trimethyl(4-methylpentyl)azanium chloride
CID 86159928
4-methylpentylazanium
CID 22348722
4-methylpentylarsane
CID 173206216
2-methylhexane;propane
CID 143695748
4-methylpentylphosphane
CID 23117374
2-methylhexane;dihydrate
CID 155319003
2-methylhexane;hydrochloride
CID 172797630
3,7,11,15-tetramethylhexadecylgallane
CID 174707879
2-methyltetratriacontane
CID 14275207

Frequently Asked Questions

What is the IUPAC name of 4-methylpentylaluminum(2+) dichloride?
The IUPAC name of 4-methylpentylaluminum(2+) dichloride (CID 20516771) is 4-methylpentylaluminum(2+) dichloride.
What is the SMILES notation for 4-methylpentylaluminum(2+) dichloride?
The canonical SMILES for 4-methylpentylaluminum(2+) dichloride is CC(C)CCC[Al+2].[Cl-].[Cl-].
What is the InChIKey of 4-methylpentylaluminum(2+) dichloride?
The InChIKey is XRLPWAWAJCCSPO-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H13.Al.2ClH/c1-4-5-6(2)3;;;/h6H,1,4-5H2,2-3H3;;2*1H/q;+2;;/p-2.
What are the key properties of 4-methylpentylaluminum(2+) dichloride?
4-methylpentylaluminum(2+) dichloride has a molecular weight of 183.06 g/mol, XLogP of -3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpentylaluminum(2+) dichloride is sourced from PubChem (CID 20516771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).