3-ethyl-3,6,7,8-tetramethylundecane

C17H36 — CID 123359808

IUPAC3-ethyl-3,6,7,8-tetramethylundecane
SMILESCCCC(C)C(C)C(C)CCC(C)(CC)CC
InChIInChI=1S/C17H36/c1-8-11-14(4)16(6)15(5)12-13-17(7,9-2)10-3/h14-16H,8-13H2,1-7H3
InChIKeyNWJWJRLILFHHBW-UHFFFAOYSA-N
MW240.47 g/mol
LogP6.30
Rot. Bonds9

About 3-ethyl-3,6,7,8-tetramethylundecane

3-ethyl-3,6,7,8-tetramethylundecane (PubChem CID 123359808) has the molecular formula C17H36 and a molecular weight of 240.47 g/mol. Its IUPAC name is 3-ethyl-3,6,7,8-tetramethylundecane.

Molecular Properties

Compound Name3-ethyl-3,6,7,8-tetramethylundecane
PubChem CID123359808
Molecular FormulaC17H36
Molecular Weight240.47 g/mol
Exact Mass240.28
IUPAC Name3-ethyl-3,6,7,8-tetramethylundecane
SMILESCCCC(C)C(C)C(C)CCC(C)(CC)CC
InChIInChI=1S/C17H36/c1-8-11-14(4)16(6)15(5)12-13-17(7,9-2)10-3/h14-16H,8-13H2,1-7H3
InChIKeyNWJWJRLILFHHBW-UHFFFAOYSA-N
XLogP6.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.47
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3,6,7,8-tetramethylundecane?
The IUPAC name of 3-ethyl-3,6,7,8-tetramethylundecane (CID 123359808) is 3-ethyl-3,6,7,8-tetramethylundecane.
What is the SMILES notation for 3-ethyl-3,6,7,8-tetramethylundecane?
The canonical SMILES for 3-ethyl-3,6,7,8-tetramethylundecane is CCCC(C)C(C)C(C)CCC(C)(CC)CC.
What is the InChIKey of 3-ethyl-3,6,7,8-tetramethylundecane?
The InChIKey is NWJWJRLILFHHBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36/c1-8-11-14(4)16(6)15(5)12-13-17(7,9-2)10-3/h14-16H,8-13H2,1-7H3.
What are the key properties of 3-ethyl-3,6,7,8-tetramethylundecane?
3-ethyl-3,6,7,8-tetramethylundecane has a molecular weight of 240.47 g/mol, XLogP of 6.30, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3,6,7,8-tetramethylundecane is sourced from PubChem (CID 123359808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).