CID 57470889

C6H6Al — CID 57470889

IUPAC—
SMILES[Al].c1ccccc1
InChIInChI=1S/C6H6.Al/c1-2-4-6-5-3-1;/h1-6H;
InChIKeyOBOYUQFWQOYBEB-UHFFFAOYSA-N
MW105.10 g/mol
LogP1.31
Rot. Bonds

About CID 57470889

CID 57470889 (PubChem CID 57470889) has the molecular formula C6H6Al and a molecular weight of 105.10 g/mol.

Molecular Properties

Compound NameCID 57470889
PubChem CID57470889
Molecular FormulaC6H6Al
Molecular Weight105.10 g/mol
Exact Mass105.03
IUPAC Name—
SMILES[Al].c1ccccc1
InChIInChI=1S/C6H6.Al/c1-2-4-6-5-3-1;/h1-6H;
InChIKeyOBOYUQFWQOYBEB-UHFFFAOYSA-N
XLogP1.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.10
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 57470889?
The IUPAC name of CID 57470889 (CID 57470889) is not available.
What is the SMILES notation for CID 57470889?
The canonical SMILES for CID 57470889 is [Al].c1ccccc1.
What is the InChIKey of CID 57470889?
The InChIKey is OBOYUQFWQOYBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.Al/c1-2-4-6-5-3-1;/h1-6H;.
What are the key properties of CID 57470889?
CID 57470889 has a molecular weight of 105.10 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57470889 is sourced from PubChem (CID 57470889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).