8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol

C40H93AlOSi3 — CID 158409046

IUPAC8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol
SMILESCC(C)CCCCCCCC[Al](CCCCCCCC[SiH](C)C)CCCCCCCC[SiH](C)C.CCCCCC[SiH](C)C.CO
InChIInChI=1S/C11H23.2C10H23Si.C8H20Si.CH4O.Al/c3*1-4-5-6-7-8-9-10-11(2)3;1-4-5-6-7-8-9(2)3;1-2;/h3*11H,1,4-10H2,2-3H3;9H,4-8H2,1-3H3;2H,1H3;
InChIKeyCTTWQBQYOKJEMJ-UHFFFAOYSA-N
MW701.42 g/mol
LogP14.18
Rot. Bonds32

About 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol

8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol (PubChem CID 158409046) has the molecular formula C40H93AlOSi3 and a molecular weight of 701.42 g/mol. Its IUPAC name is 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol.

Molecular Properties

Compound Name8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol
PubChem CID158409046
Molecular FormulaC40H93AlOSi3
Molecular Weight701.42 g/mol
Exact Mass700.63
IUPAC Name8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol
SMILESCC(C)CCCCCCCC[Al](CCCCCCCC[SiH](C)C)CCCCCCCC[SiH](C)C.CCCCCC[SiH](C)C.CO
InChIInChI=1S/C11H23.2C10H23Si.C8H20Si.CH4O.Al/c3*1-4-5-6-7-8-9-10-11(2)3;1-4-5-6-7-8-9(2)3;1-2;/h3*11H,1,4-10H2,2-3H3;9H,4-8H2,1-3H3;2H,1H3;
InChIKeyCTTWQBQYOKJEMJ-UHFFFAOYSA-N
XLogP14.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds32
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500701.42
LogP ≤ 514.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tris(7-methyloctyl)alumane
CID 156702571
2-methyldecane
CID 23415
2-methylpentaoctacontane
CID 90745672
2-methyltetratriacontane
CID 14275207
dimethyl(nonyl)silane
CID 71400453
2-methyloctacosane
CID 519147
hydroxylamine;2-methylnonadecane
CID 87902402
azane;2-methyloctadecane
CID 175414560
2-methylnonane;heptahydrofluoride
CID 160801749
alumane;2-methyldecane
CID 174844655
methane;2-methylicosane
CID 157337652
2-methyltricosane;hydrate
CID 172783998

Frequently Asked Questions

What is the IUPAC name of 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol?
The IUPAC name of 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol (CID 158409046) is 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol.
What is the SMILES notation for 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol?
The canonical SMILES for 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol is CC(C)CCCCCCCC[Al](CCCCCCCC[SiH](C)C)CCCCCCCC[SiH](C)C.CCCCCC[SiH](C)C.CO.
What is the InChIKey of 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol?
The InChIKey is CTTWQBQYOKJEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23.2C10H23Si.C8H20Si.CH4O.Al/c3*1-4-5-6-7-8-9-10-11(2)3;1-4-5-6-7-8-9(2)3;1-2;/h3*11H,1,4-10H2,2-3H3;9H,4-8H2,1-3H3;2H,1H3;.
What are the key properties of 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol?
8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol has a molecular weight of 701.42 g/mol, XLogP of 14.18, 32 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[8-dimethylsilyloctyl(9-methyldecyl)alumanyl]octyl-dimethylsilane;hexyl(dimethyl)silane;methanol is sourced from PubChem (CID 158409046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).