Aluminum, hydrobis(2,4,4-trimethylpentyl)-

C16H34Al — CID 16684520

IUPAC—
SMILESCC(C[Al]CC(C)CC(C)(C)C)CC(C)(C)C
InChIInChI=1S/2C8H17.Al/c2*1-7(2)6-8(3,4)5;/h2*7H,1,6H2,2-5H3;
InChIKeyDSDJNWYBXQXLRZ-UHFFFAOYSA-N
MW253.43 g/mol
LogP5.67
Rot. Bonds6

About Aluminum, hydrobis(2,4,4-trimethylpentyl)-

Aluminum, hydrobis(2,4,4-trimethylpentyl)- (PubChem CID 16684520) has the molecular formula C16H34Al and a molecular weight of 253.43 g/mol.

Molecular Properties

Compound NameAluminum, hydrobis(2,4,4-trimethylpentyl)-
PubChem CID16684520
Molecular FormulaC16H34Al
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name—
SMILESCC(C[Al]CC(C)CC(C)(C)C)CC(C)(C)C
InChIInChI=1S/2C8H17.Al/c2*1-7(2)6-8(3,4)5;/h2*7H,1,6H2,2-5H3;
InChIKeyDSDJNWYBXQXLRZ-UHFFFAOYSA-N
XLogP5.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.43
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;2,2,4,6,6-pentamethylheptane
CID 142211592
(4S)-2,4,6,6-tetramethylheptan-2-amine
CID 167006603
2,2,4,8,10,10-hexamethylundecane
CID 54023173
methane;2,2,4-trimethylhexane
CID 159659116
azane;2,2,4-trimethylhexane
CID 87634842
CID 102521820
CID 102521820
bis(2,4,4-trimethylpentyl)phosphane
CID 19428770
lithium 2,2,4-trimethylhexane
CID 19358976
N-ethyl-N,2,4,4-tetramethylpentan-1-amine
CID 163702112
propane;2,4,4-trimethylpentylphosphane
CID 174469111
1,1-dichloro-3,5,5-trimethylhexane
CID 91082189
2,2,4,4,6,8,8-heptamethylnonane;hexadecane
CID 162121886

Frequently Asked Questions

What is the IUPAC name of Aluminum, hydrobis(2,4,4-trimethylpentyl)-?
The IUPAC name of Aluminum, hydrobis(2,4,4-trimethylpentyl)- (CID 16684520) is not available.
What is the SMILES notation for Aluminum, hydrobis(2,4,4-trimethylpentyl)-?
The canonical SMILES for Aluminum, hydrobis(2,4,4-trimethylpentyl)- is CC(C[Al]CC(C)CC(C)(C)C)CC(C)(C)C.
What is the InChIKey of Aluminum, hydrobis(2,4,4-trimethylpentyl)-?
The InChIKey is DSDJNWYBXQXLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17.Al/c2*1-7(2)6-8(3,4)5;/h2*7H,1,6H2,2-5H3;.
What are the key properties of Aluminum, hydrobis(2,4,4-trimethylpentyl)-?
Aluminum, hydrobis(2,4,4-trimethylpentyl)- has a molecular weight of 253.43 g/mol, XLogP of 5.67, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Aluminum, hydrobis(2,4,4-trimethylpentyl)- is sourced from PubChem (CID 16684520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).