aluminum;bis(2-methanidylpropane);bromide

C8H18AlBr — CID 11287466

IUPACaluminum;bis(2-methanidylpropane);bromide
SMILES[Al+3].[Br-].[CH2-]C(C)C.[CH2-]C(C)C
InChIInChI=1S/2C4H9.Al.BrH/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;;1H/q2*-1;+3;/p-1
InChIKeyTZJIFHDEUAHWDR-UHFFFAOYSA-M
MW221.12 g/mol
LogP-0.42
Rot. Bonds

About aluminum;bis(2-methanidylpropane);bromide

aluminum;bis(2-methanidylpropane);bromide (PubChem CID 11287466) has the molecular formula C8H18AlBr and a molecular weight of 221.12 g/mol. Its IUPAC name is aluminum;bis(2-methanidylpropane);bromide.

Molecular Properties

Compound Namealuminum;bis(2-methanidylpropane);bromide
PubChem CID11287466
Molecular FormulaC8H18AlBr
Molecular Weight221.12 g/mol
Exact Mass220.04
IUPAC Namealuminum;bis(2-methanidylpropane);bromide
SMILES[Al+3].[Br-].[CH2-]C(C)C.[CH2-]C(C)C
InChIInChI=1S/2C4H9.Al.BrH/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;;1H/q2*-1;+3;/p-1
InChIKeyTZJIFHDEUAHWDR-UHFFFAOYSA-M
XLogP-0.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.12
LogP ≤ 5-0.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

zinc;2-methanidylpropane;bromide
CID 24942246
2-methanidylpropane;decakis(yttrium)
CID 167360236
aluminum;dimethylazanide;bis(2-methanidylpropane)
CID 15977879
2-methanidylpropane;titanium(4+);trichloride
CID 174197579
ethane;2-methanidylpropane;tungsten(2+)
CID 20607309
2-methanidylpropane;zirconium;trihydrochloride
CID 175005550
bis(2-methanidylpropane);titanium(2+);dihydrobromide
CID 175007215
carbanide;2-methanidylpropane;bis(yttrium)
CID 161365817
sodium;2-methanidylpropane;hydroxide
CID 58205934
bis(2-methanidylpropane);zirconium(2+);dihydrate
CID 164789346
azanide;2-methanidylpropane;titanium(4+);dichloride
CID 174308644
carbanide;2-methanidylpropane;tungsten;uranium
CID 158124011

Frequently Asked Questions

What is the IUPAC name of aluminum;bis(2-methanidylpropane);bromide?
The IUPAC name of aluminum;bis(2-methanidylpropane);bromide (CID 11287466) is aluminum;bis(2-methanidylpropane);bromide.
What is the SMILES notation for aluminum;bis(2-methanidylpropane);bromide?
The canonical SMILES for aluminum;bis(2-methanidylpropane);bromide is [Al+3].[Br-].[CH2-]C(C)C.[CH2-]C(C)C.
What is the InChIKey of aluminum;bis(2-methanidylpropane);bromide?
The InChIKey is TZJIFHDEUAHWDR-UHFFFAOYSA-M. The full InChI is InChI=1S/2C4H9.Al.BrH/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;;1H/q2*-1;+3;/p-1.
What are the key properties of aluminum;bis(2-methanidylpropane);bromide?
aluminum;bis(2-methanidylpropane);bromide has a molecular weight of 221.12 g/mol, XLogP of -0.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;bis(2-methanidylpropane);bromide is sourced from PubChem (CID 11287466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).