2,4,7,9-tetramethylundecane

C15H32 — CID 91346710

IUPAC2,4,7,9-tetramethylundecane
SMILESCCC(C)CC(C)CCC(C)CC(C)C
InChIInChI=1S/C15H32/c1-7-13(4)11-15(6)9-8-14(5)10-12(2)3/h12-15H,7-11H2,1-6H3
InChIKeyONTUGUNXUNMHDT-UHFFFAOYSA-N
MW212.42 g/mol
LogP5.52
Rot. Bonds8

About 2,4,7,9-tetramethylundecane

2,4,7,9-tetramethylundecane (PubChem CID 91346710) has the molecular formula C15H32 and a molecular weight of 212.42 g/mol. Its IUPAC name is 2,4,7,9-tetramethylundecane.

Molecular Properties

Compound Name2,4,7,9-tetramethylundecane
PubChem CID91346710
Molecular FormulaC15H32
Molecular Weight212.42 g/mol
Exact Mass212.25
IUPAC Name2,4,7,9-tetramethylundecane
SMILESCCC(C)CC(C)CCC(C)CC(C)C
InChIInChI=1S/C15H32/c1-7-13(4)11-15(6)9-8-14(5)10-12(2)3/h12-15H,7-11H2,1-6H3
InChIKeyONTUGUNXUNMHDT-UHFFFAOYSA-N
XLogP5.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.42
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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3,5-dimethylheptane;ethane
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2,4,6,8,10,12-hexamethylpentadecane
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3,5-dimethylheptane;3,4-dimethylhexane;3,6-dimethyloctane
CID 161182355
2,4,6,8,10,12,14-heptamethylheptadecane
CID 91613417
2,4-dimethylhexane;hexane
CID 174686373
2,4,6,8,10-pentamethyltridecane
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Frequently Asked Questions

What is the IUPAC name of 2,4,7,9-tetramethylundecane?
The IUPAC name of 2,4,7,9-tetramethylundecane (CID 91346710) is 2,4,7,9-tetramethylundecane.
What is the SMILES notation for 2,4,7,9-tetramethylundecane?
The canonical SMILES for 2,4,7,9-tetramethylundecane is CCC(C)CC(C)CCC(C)CC(C)C.
What is the InChIKey of 2,4,7,9-tetramethylundecane?
The InChIKey is ONTUGUNXUNMHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32/c1-7-13(4)11-15(6)9-8-14(5)10-12(2)3/h12-15H,7-11H2,1-6H3.
What are the key properties of 2,4,7,9-tetramethylundecane?
2,4,7,9-tetramethylundecane has a molecular weight of 212.42 g/mol, XLogP of 5.52, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,7,9-tetramethylundecane is sourced from PubChem (CID 91346710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).