2,2,5,8,10,10-hexamethyldodecane

C18H38 — CID 177102228

IUPAC2,2,5,8,10,10-hexamethyldodecane
SMILESCCC(C)(C)CC(C)CCC(C)CCC(C)(C)C
InChIInChI=1S/C18H38/c1-9-18(7,8)14-16(3)11-10-15(2)12-13-17(4,5)6/h15-16H,9-14H2,1-8H3
InChIKeyLXLADIWDJAYJDM-UHFFFAOYSA-N
MW254.50 g/mol
LogP6.69
Rot. Bonds8

About 2,2,5,8,10,10-hexamethyldodecane

2,2,5,8,10,10-hexamethyldodecane (PubChem CID 177102228) has the molecular formula C18H38 and a molecular weight of 254.50 g/mol. Its IUPAC name is 2,2,5,8,10,10-hexamethyldodecane.

Molecular Properties

Compound Name2,2,5,8,10,10-hexamethyldodecane
PubChem CID177102228
Molecular FormulaC18H38
Molecular Weight254.50 g/mol
Exact Mass254.30
IUPAC Name2,2,5,8,10,10-hexamethyldodecane
SMILESCCC(C)(C)CC(C)CCC(C)CCC(C)(C)C
InChIInChI=1S/C18H38/c1-9-18(7,8)14-16(3)11-10-15(2)12-13-17(4,5)6/h15-16H,9-14H2,1-8H3
InChIKeyLXLADIWDJAYJDM-UHFFFAOYSA-N
XLogP6.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.50
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,8,10,10-hexamethyldodecane?
The IUPAC name of 2,2,5,8,10,10-hexamethyldodecane (CID 177102228) is 2,2,5,8,10,10-hexamethyldodecane.
What is the SMILES notation for 2,2,5,8,10,10-hexamethyldodecane?
The canonical SMILES for 2,2,5,8,10,10-hexamethyldodecane is CCC(C)(C)CC(C)CCC(C)CCC(C)(C)C.
What is the InChIKey of 2,2,5,8,10,10-hexamethyldodecane?
The InChIKey is LXLADIWDJAYJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38/c1-9-18(7,8)14-16(3)11-10-15(2)12-13-17(4,5)6/h15-16H,9-14H2,1-8H3.
What are the key properties of 2,2,5,8,10,10-hexamethyldodecane?
2,2,5,8,10,10-hexamethyldodecane has a molecular weight of 254.50 g/mol, XLogP of 6.69, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,8,10,10-hexamethyldodecane is sourced from PubChem (CID 177102228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).