CID 173454571

C18H34ClPb — CID 173454571

IUPAC—
SMILESC1CCC([Pb](C2CCCCC2)C2CCCCC2)CC1.Cl
InChIInChI=1S/3C6H11.ClH.Pb/c3*1-2-4-6-5-3-1;;/h3*1H,2-6H2;1H;
InChIKeyYCHKKWUOHLVMOC-UHFFFAOYSA-N
MW493.12 g/mol
LogP6.91
Rot. Bonds3

About CID 173454571

CID 173454571 (PubChem CID 173454571) has the molecular formula C18H34ClPb and a molecular weight of 493.12 g/mol.

Molecular Properties

Compound NameCID 173454571
PubChem CID173454571
Molecular FormulaC18H34ClPb
Molecular Weight493.12 g/mol
Exact Mass493.21
IUPAC Name—
SMILESC1CCC([Pb](C2CCCCC2)C2CCCCC2)CC1.Cl
InChIInChI=1S/3C6H11.ClH.Pb/c3*1-2-4-6-5-3-1;;/h3*1H,2-6H2;1H;
InChIKeyYCHKKWUOHLVMOC-UHFFFAOYSA-N
XLogP6.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.12
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 13442627
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CID 16776852
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methylcyclohexane;phosphane;pentahydrochloride
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tricyclo[5.4.0.08,11]undecane
CID 176586412

Frequently Asked Questions

What is the IUPAC name of CID 173454571?
The IUPAC name of CID 173454571 (CID 173454571) is not available.
What is the SMILES notation for CID 173454571?
The canonical SMILES for CID 173454571 is C1CCC([Pb](C2CCCCC2)C2CCCCC2)CC1.Cl.
What is the InChIKey of CID 173454571?
The InChIKey is YCHKKWUOHLVMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H11.ClH.Pb/c3*1-2-4-6-5-3-1;;/h3*1H,2-6H2;1H;.
What are the key properties of CID 173454571?
CID 173454571 has a molecular weight of 493.12 g/mol, XLogP of 6.91, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173454571 is sourced from PubChem (CID 173454571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).