ethenyl-methyl-phenylalumane

C9H11Al — CID 154135321

IUPACethenyl-methyl-phenylalumane
SMILESC=C[Al](C)c1ccccc1
InChIInChI=1S/C6H5.C2H3.CH3.Al/c1-2-4-6-5-3-1;1-2;;/h1-5H;1H,2H2;1H3;
InChIKeyNICSPLDCNVVRRX-UHFFFAOYSA-N
MW146.17 g/mol
LogP1.74
Rot. Bonds2

About ethenyl-methyl-phenylalumane

ethenyl-methyl-phenylalumane (PubChem CID 154135321) has the molecular formula C9H11Al and a molecular weight of 146.17 g/mol. Its IUPAC name is ethenyl-methyl-phenylalumane.

Molecular Properties

Compound Nameethenyl-methyl-phenylalumane
PubChem CID154135321
Molecular FormulaC9H11Al
Molecular Weight146.17 g/mol
Exact Mass146.07
IUPAC Nameethenyl-methyl-phenylalumane
SMILESC=C[Al](C)c1ccccc1
InChIInChI=1S/C6H5.C2H3.CH3.Al/c1-2-4-6-5-3-1;1-2;;/h1-5H;1H,2H2;1H3;
InChIKeyNICSPLDCNVVRRX-UHFFFAOYSA-N
XLogP1.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.17
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-phenylalumane?
The IUPAC name of ethenyl-methyl-phenylalumane (CID 154135321) is ethenyl-methyl-phenylalumane.
What is the SMILES notation for ethenyl-methyl-phenylalumane?
The canonical SMILES for ethenyl-methyl-phenylalumane is C=C[Al](C)c1ccccc1.
What is the InChIKey of ethenyl-methyl-phenylalumane?
The InChIKey is NICSPLDCNVVRRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5.C2H3.CH3.Al/c1-2-4-6-5-3-1;1-2;;/h1-5H;1H,2H2;1H3;.
What are the key properties of ethenyl-methyl-phenylalumane?
ethenyl-methyl-phenylalumane has a molecular weight of 146.17 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-phenylalumane is sourced from PubChem (CID 154135321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).