2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane

C24H50 — CID 158947018

IUPAC2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane
SMILESCC(C)(C)CC(C)(C)CC(C)(C)C(C)(C)CC(C)(C)CC(C)(C)C
InChIInChI=1S/C24H50/c1-19(2,3)15-21(7,8)17-23(11,12)24(13,14)18-22(9,10)16-20(4,5)6/h15-18H2,1-14H3
InChIKeyJKYIRBILVZBRHO-UHFFFAOYSA-N
MW338.66 g/mol
LogP8.74
Rot. Bonds7

About 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane

2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane (PubChem CID 158947018) has the molecular formula C24H50 and a molecular weight of 338.66 g/mol. Its IUPAC name is 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane.

Molecular Properties

Compound Name2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane
PubChem CID158947018
Molecular FormulaC24H50
Molecular Weight338.66 g/mol
Exact Mass338.39
IUPAC Name2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane
SMILESCC(C)(C)CC(C)(C)CC(C)(C)C(C)(C)CC(C)(C)CC(C)(C)C
InChIInChI=1S/C24H50/c1-19(2,3)15-21(7,8)17-23(11,12)24(13,14)18-22(9,10)16-20(4,5)6/h15-18H2,1-14H3
InChIKeyJKYIRBILVZBRHO-UHFFFAOYSA-N
XLogP8.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.66
LogP ≤ 58.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,2,4,4,6,6-hexamethylheptane
CID 2795065
2,2,4,4,6,6-hexamethylheptane;molecular hydrogen
CID 167544338
2,4,4,6,6-pentamethylheptan-2-ylazanium
CID 23591642
2,4,4,6,6-pentamethylheptan-2-ylchloranium
CID 140547290
2,3,4,4,6,6,8,8-octamethylnon-2-ene
CID 58468529
2,2,3,3,5,5,6,6,8,8,10,10-dodecamethyldodecane
CID 58975644
ethane;2,2,4,4-tetramethylheptane
CID 143291913
dimethyl(2,2,4,4-tetramethylpentyl)phosphane
CID 134477410
2,4,4,6,6,8,8,10,10-nonamethylundec-1-ene
CID 163753121
2,4,4,6,6,8,8-heptamethylnon-1-ene
CID 545785
2,3,4,4,6,6,8,8-octamethylnon-2-ene;vanadium
CID 159855533
2,4,4,6,6,8,8-heptamethylnonylsilane
CID 150942807

Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane?
The IUPAC name of 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane (CID 158947018) is 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane.
What is the SMILES notation for 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane?
The canonical SMILES for 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane is CC(C)(C)CC(C)(C)CC(C)(C)C(C)(C)CC(C)(C)CC(C)(C)C.
What is the InChIKey of 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane?
The InChIKey is JKYIRBILVZBRHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50/c1-19(2,3)15-21(7,8)17-23(11,12)24(13,14)18-22(9,10)16-20(4,5)6/h15-18H2,1-14H3.
What are the key properties of 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane?
2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane has a molecular weight of 338.66 g/mol, XLogP of 8.74, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,6,6,7,7,9,9,11,11-dodecamethyldodecane is sourced from PubChem (CID 158947018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).