dimethyl(nonadecyl)alumane

C21H45Al — CID 142743873

IUPACdimethyl(nonadecyl)alumane
SMILESCCCCCCCCCCCCCCCCCCC[Al](C)C
InChIInChI=1S/C19H39.2CH3.Al/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;;;/h1,3-19H2,2H3;2*1H3;
InChIKeyFGJBQPYLDISWMV-UHFFFAOYSA-N
MW324.57 g/mol
LogP8.39
Rot. Bonds18

About dimethyl(nonadecyl)alumane

dimethyl(nonadecyl)alumane (PubChem CID 142743873) has the molecular formula C21H45Al and a molecular weight of 324.57 g/mol. Its IUPAC name is dimethyl(nonadecyl)alumane.

Molecular Properties

Compound Namedimethyl(nonadecyl)alumane
PubChem CID142743873
Molecular FormulaC21H45Al
Molecular Weight324.57 g/mol
Exact Mass324.33
IUPAC Namedimethyl(nonadecyl)alumane
SMILESCCCCCCCCCCCCCCCCCCC[Al](C)C
InChIInChI=1S/C19H39.2CH3.Al/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;;;/h1,3-19H2,2H3;2*1H3;
InChIKeyFGJBQPYLDISWMV-UHFFFAOYSA-N
XLogP8.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.57
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

heptane;trihexylalumane
CID 22011139
CID 161246447
CID 161246447
dohexacontane
CID 522644
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
henoctacontane
CID 22086342
triacontane
CID 12535
dictane
CID 19848341
heptahectane
CID 123338944

Frequently Asked Questions

What is the IUPAC name of dimethyl(nonadecyl)alumane?
The IUPAC name of dimethyl(nonadecyl)alumane (CID 142743873) is dimethyl(nonadecyl)alumane.
What is the SMILES notation for dimethyl(nonadecyl)alumane?
The canonical SMILES for dimethyl(nonadecyl)alumane is CCCCCCCCCCCCCCCCCCC[Al](C)C.
What is the InChIKey of dimethyl(nonadecyl)alumane?
The InChIKey is FGJBQPYLDISWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39.2CH3.Al/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;;;/h1,3-19H2,2H3;2*1H3;.
What are the key properties of dimethyl(nonadecyl)alumane?
dimethyl(nonadecyl)alumane has a molecular weight of 324.57 g/mol, XLogP of 8.39, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(nonadecyl)alumane is sourced from PubChem (CID 142743873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).