CID 68982251

C18H24Li — CID 68982251

IUPAC—
SMILESC1=CCCC=C1.C1=CCCC=C1.C1=CCCC=C1.[Li]
InChIInChI=1S/3C6H8.Li/c3*1-2-4-6-5-3-1;/h3*1-4H,5-6H2;
InChIKeyLEQINJZENZGTKU-UHFFFAOYSA-N
MW247.33 g/mol
LogP5.30
Rot. Bonds

About CID 68982251

CID 68982251 (PubChem CID 68982251) has the molecular formula C18H24Li and a molecular weight of 247.33 g/mol.

Molecular Properties

Compound NameCID 68982251
PubChem CID68982251
Molecular FormulaC18H24Li
Molecular Weight247.33 g/mol
Exact Mass247.20
IUPAC Name—
SMILESC1=CCCC=C1.C1=CCCC=C1.C1=CCCC=C1.[Li]
InChIInChI=1S/3C6H8.Li/c3*1-2-4-6-5-3-1;/h3*1-4H,5-6H2;
InChIKeyLEQINJZENZGTKU-UHFFFAOYSA-N
XLogP5.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500247.33
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 68982251?
The IUPAC name of CID 68982251 (CID 68982251) is not available.
What is the SMILES notation for CID 68982251?
The canonical SMILES for CID 68982251 is C1=CCCC=C1.C1=CCCC=C1.C1=CCCC=C1.[Li].
What is the InChIKey of CID 68982251?
The InChIKey is LEQINJZENZGTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H8.Li/c3*1-2-4-6-5-3-1;/h3*1-4H,5-6H2;.
What are the key properties of CID 68982251?
CID 68982251 has a molecular weight of 247.33 g/mol, XLogP of 5.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68982251 is sourced from PubChem (CID 68982251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).