CID 175472927

C14H22Al — CID 175472927

IUPAC—
SMILESCC(C)(C)c1ccccc1C(C)(C)C.[Al]
InChIInChI=1S/C14H22.Al/c1-13(2,3)11-9-7-8-10-12(11)14(4,5)6;/h7-10H,1-6H3;
InChIKeyXVWORROKDGMPMY-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.90
Rot. Bonds

About CID 175472927

CID 175472927 (PubChem CID 175472927) has the molecular formula C14H22Al and a molecular weight of 217.31 g/mol.

Molecular Properties

Compound NameCID 175472927
PubChem CID175472927
Molecular FormulaC14H22Al
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name—
SMILESCC(C)(C)c1ccccc1C(C)(C)C.[Al]
InChIInChI=1S/C14H22.Al/c1-13(2,3)11-9-7-8-10-12(11)14(4,5)6;/h7-10H,1-6H3;
InChIKeyXVWORROKDGMPMY-UHFFFAOYSA-N
XLogP3.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 175472927?
The IUPAC name of CID 175472927 (CID 175472927) is not available.
What is the SMILES notation for CID 175472927?
The canonical SMILES for CID 175472927 is CC(C)(C)c1ccccc1C(C)(C)C.[Al].
What is the InChIKey of CID 175472927?
The InChIKey is XVWORROKDGMPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22.Al/c1-13(2,3)11-9-7-8-10-12(11)14(4,5)6;/h7-10H,1-6H3;.
What are the key properties of CID 175472927?
CID 175472927 has a molecular weight of 217.31 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175472927 is sourced from PubChem (CID 175472927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).