CID 87518738

C15H11Al — CID 87518738

IUPAC—
SMILES[Al]C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/C15H11.Al/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;/h1-11H;
InChIKeyNGYYNOJMXWZXEE-UHFFFAOYSA-N
MW218.23 g/mol
LogP3.34
Rot. Bonds1

About CID 87518738

CID 87518738 (PubChem CID 87518738) has the molecular formula C15H11Al and a molecular weight of 218.23 g/mol.

Molecular Properties

Compound NameCID 87518738
PubChem CID87518738
Molecular FormulaC15H11Al
Molecular Weight218.23 g/mol
Exact Mass218.07
IUPAC Name—
SMILES[Al]C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/C15H11.Al/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;/h1-11H;
InChIKeyNGYYNOJMXWZXEE-UHFFFAOYSA-N
XLogP3.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 87518738?
The IUPAC name of CID 87518738 (CID 87518738) is not available.
What is the SMILES notation for CID 87518738?
The canonical SMILES for CID 87518738 is [Al]C1C=C(c2ccccc2)c2ccccc21.
What is the InChIKey of CID 87518738?
The InChIKey is NGYYNOJMXWZXEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11.Al/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;/h1-11H;.
What are the key properties of CID 87518738?
CID 87518738 has a molecular weight of 218.23 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87518738 is sourced from PubChem (CID 87518738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).