2,2,4,8,10,10-hexamethylundecane

C17H36 — CID 54023173

IUPAC2,2,4,8,10,10-hexamethylundecane
SMILESCC(CCCC(C)CC(C)(C)C)CC(C)(C)C
InChIInChI=1S/C17H36/c1-14(12-16(3,4)5)10-9-11-15(2)13-17(6,7)8/h14-15H,9-13H2,1-8H3
InChIKeyKFZVDXQVSQAJHC-UHFFFAOYSA-N
MW240.47 g/mol
LogP6.30
Rot. Bonds6

About 2,2,4,8,10,10-hexamethylundecane

2,2,4,8,10,10-hexamethylundecane (PubChem CID 54023173) has the molecular formula C17H36 and a molecular weight of 240.47 g/mol. Its IUPAC name is 2,2,4,8,10,10-hexamethylundecane.

Molecular Properties

Compound Name2,2,4,8,10,10-hexamethylundecane
PubChem CID54023173
Molecular FormulaC17H36
Molecular Weight240.47 g/mol
Exact Mass240.28
IUPAC Name2,2,4,8,10,10-hexamethylundecane
SMILESCC(CCCC(C)CC(C)(C)C)CC(C)(C)C
InChIInChI=1S/C17H36/c1-14(12-16(3,4)5)10-9-11-15(2)13-17(6,7)8/h14-15H,9-13H2,1-8H3
InChIKeyKFZVDXQVSQAJHC-UHFFFAOYSA-N
XLogP6.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
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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Related Compounds

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2,2,4-trimethylundecane
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4,6,6-trimethyl-1-methylsulfanylheptane
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ethane;2,2,4,6,6-pentamethylheptane
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6,8,8-trimethylnon-1-ene
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3,5,5-trimethyl-1-[3-[3-[3-(3,5,5-trimethylhexoxy)propoxy]propoxy]propoxy]hexane
CID 58682902
acetic acid;5,7,7-trimethyloctanoic acid
CID 162192888
ethylperoxyethane;3-methylheptane;2,2,4-trimethylhexane
CID 160854637
3,5,5-trimethyl-1-[2-(3,5,5-trimethylhexoxy)propan-2-yloxy]hexane
CID 141134456
1-ethoxy-3,5,5-trimethylhexane
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Frequently Asked Questions

What is the IUPAC name of 2,2,4,8,10,10-hexamethylundecane?
The IUPAC name of 2,2,4,8,10,10-hexamethylundecane (CID 54023173) is 2,2,4,8,10,10-hexamethylundecane.
What is the SMILES notation for 2,2,4,8,10,10-hexamethylundecane?
The canonical SMILES for 2,2,4,8,10,10-hexamethylundecane is CC(CCCC(C)CC(C)(C)C)CC(C)(C)C.
What is the InChIKey of 2,2,4,8,10,10-hexamethylundecane?
The InChIKey is KFZVDXQVSQAJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36/c1-14(12-16(3,4)5)10-9-11-15(2)13-17(6,7)8/h14-15H,9-13H2,1-8H3.
What are the key properties of 2,2,4,8,10,10-hexamethylundecane?
2,2,4,8,10,10-hexamethylundecane has a molecular weight of 240.47 g/mol, XLogP of 6.30, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,8,10,10-hexamethylundecane is sourced from PubChem (CID 54023173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).