tetracyclo[5.4.1.04,12.09,12]dodecane

C12H18 — CID 12907941

IUPACtetracyclo[5.4.1.04,12.09,12]dodecane
SMILESC1CC2CCC3CC4CCC1C243
InChIInChI=1S/C12H18/c1-2-9-4-6-11-7-10-5-3-8(1)12(9,10)11/h8-11H,1-7H2
InChIKeyGVMFDGIGYTULHS-UHFFFAOYSA-N
MW162.28 g/mol
LogP3.22
Rot. Bonds

About tetracyclo[5.4.1.04,12.09,12]dodecane

tetracyclo[5.4.1.04,12.09,12]dodecane (PubChem CID 12907941) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is tetracyclo[5.4.1.04,12.09,12]dodecane.

Molecular Properties

Compound Nametetracyclo[5.4.1.04,12.09,12]dodecane
PubChem CID12907941
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Nametetracyclo[5.4.1.04,12.09,12]dodecane
SMILESC1CC2CCC3CC4CCC1C243
InChIInChI=1S/C12H18/c1-2-9-4-6-11-7-10-5-3-8(1)12(9,10)11/h8-11H,1-7H2
InChIKeyGVMFDGIGYTULHS-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tetracyclo[5.4.1.04,12.09,12]dodecane?
The IUPAC name of tetracyclo[5.4.1.04,12.09,12]dodecane (CID 12907941) is tetracyclo[5.4.1.04,12.09,12]dodecane.
What is the SMILES notation for tetracyclo[5.4.1.04,12.09,12]dodecane?
The canonical SMILES for tetracyclo[5.4.1.04,12.09,12]dodecane is C1CC2CCC3CC4CCC1C243.
What is the InChIKey of tetracyclo[5.4.1.04,12.09,12]dodecane?
The InChIKey is GVMFDGIGYTULHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-2-9-4-6-11-7-10-5-3-8(1)12(9,10)11/h8-11H,1-7H2.
What are the key properties of tetracyclo[5.4.1.04,12.09,12]dodecane?
tetracyclo[5.4.1.04,12.09,12]dodecane has a molecular weight of 162.28 g/mol, XLogP of 3.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[5.4.1.04,12.09,12]dodecane is sourced from PubChem (CID 12907941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).