CID 173153342

C18H25Al — CID 173153342

IUPAC—
SMILES[Al]c1cccc(C2CCCCC2)c1C1CCCCC1
InChIInChI=1S/C18H25.Al/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;/h7-8,13,15-16H,1-6,9-12H2;
InChIKeyYBXLSSLWAOBGCC-UHFFFAOYSA-N
MW268.38 g/mol
LogP4.58
Rot. Bonds2

About CID 173153342

CID 173153342 (PubChem CID 173153342) has the molecular formula C18H25Al and a molecular weight of 268.38 g/mol.

Molecular Properties

Compound NameCID 173153342
PubChem CID173153342
Molecular FormulaC18H25Al
Molecular Weight268.38 g/mol
Exact Mass268.18
IUPAC Name—
SMILES[Al]c1cccc(C2CCCCC2)c1C1CCCCC1
InChIInChI=1S/C18H25.Al/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;/h7-8,13,15-16H,1-6,9-12H2;
InChIKeyYBXLSSLWAOBGCC-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 173153342?
The IUPAC name of CID 173153342 (CID 173153342) is not available.
What is the SMILES notation for CID 173153342?
The canonical SMILES for CID 173153342 is [Al]c1cccc(C2CCCCC2)c1C1CCCCC1.
What is the InChIKey of CID 173153342?
The InChIKey is YBXLSSLWAOBGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25.Al/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16;/h7-8,13,15-16H,1-6,9-12H2;.
What are the key properties of CID 173153342?
CID 173153342 has a molecular weight of 268.38 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173153342 is sourced from PubChem (CID 173153342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).