CID 140568629

C14H13Al — CID 140568629

IUPAC—
SMILES[Al]CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H13.Al/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-12H,1H2;
InChIKeySQDRYZBKLWVGLQ-UHFFFAOYSA-N
MW208.24 g/mol
LogP3.41
Rot. Bonds3

About CID 140568629

CID 140568629 (PubChem CID 140568629) has the molecular formula C14H13Al and a molecular weight of 208.24 g/mol.

Molecular Properties

Compound NameCID 140568629
PubChem CID140568629
Molecular FormulaC14H13Al
Molecular Weight208.24 g/mol
Exact Mass208.08
IUPAC Name—
SMILES[Al]CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H13.Al/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-12H,1H2;
InChIKeySQDRYZBKLWVGLQ-UHFFFAOYSA-N
XLogP3.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 140568629?
The IUPAC name of CID 140568629 (CID 140568629) is not available.
What is the SMILES notation for CID 140568629?
The canonical SMILES for CID 140568629 is [Al]CC(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 140568629?
The InChIKey is SQDRYZBKLWVGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13.Al/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-12H,1H2;.
What are the key properties of CID 140568629?
CID 140568629 has a molecular weight of 208.24 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140568629 is sourced from PubChem (CID 140568629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).