2,2,3,4,6,7,8,9-octamethyldodecane

C20H42 — CID 123701527

IUPAC2,2,3,4,6,7,8,9-octamethyldodecane
SMILESCCCC(C)C(C)C(C)C(C)CC(C)C(C)C(C)(C)C
InChIInChI=1S/C20H42/c1-11-12-14(2)17(5)18(6)15(3)13-16(4)19(7)20(8,9)10/h14-19H,11-13H2,1-10H3
InChIKeyUWXNBQGTMYPVRA-UHFFFAOYSA-N
MW282.56 g/mol
LogP7.04
Rot. Bonds8

About 2,2,3,4,6,7,8,9-octamethyldodecane

2,2,3,4,6,7,8,9-octamethyldodecane (PubChem CID 123701527) has the molecular formula C20H42 and a molecular weight of 282.56 g/mol. Its IUPAC name is 2,2,3,4,6,7,8,9-octamethyldodecane.

Molecular Properties

Compound Name2,2,3,4,6,7,8,9-octamethyldodecane
PubChem CID123701527
Molecular FormulaC20H42
Molecular Weight282.56 g/mol
Exact Mass282.33
IUPAC Name2,2,3,4,6,7,8,9-octamethyldodecane
SMILESCCCC(C)C(C)C(C)C(C)CC(C)C(C)C(C)(C)C
InChIInChI=1S/C20H42/c1-11-12-14(2)17(5)18(6)15(3)13-16(4)19(7)20(8,9)10/h14-19H,11-13H2,1-10H3
InChIKeyUWXNBQGTMYPVRA-UHFFFAOYSA-N
XLogP7.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.56
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2,2,5,6-tetramethyl-4-propan-2-ylnonane
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2,2,3-trimethyl-4-propyloctane
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3-ethyl-3,6,7,8-tetramethylundecane
CID 123359808
3-ethyl-2,2,4-trimethylheptane
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3-fluoro-2,2,4-trimethylheptane
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6-(3,3-dimethylbutan-2-yl)-3,4-dimethyldecane
CID 123656705
2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,22,23,24,25,26,27,28,29,30,31,32-triacontamethyltritriacontane
CID 20659071

Frequently Asked Questions

What is the IUPAC name of 2,2,3,4,6,7,8,9-octamethyldodecane?
The IUPAC name of 2,2,3,4,6,7,8,9-octamethyldodecane (CID 123701527) is 2,2,3,4,6,7,8,9-octamethyldodecane.
What is the SMILES notation for 2,2,3,4,6,7,8,9-octamethyldodecane?
The canonical SMILES for 2,2,3,4,6,7,8,9-octamethyldodecane is CCCC(C)C(C)C(C)C(C)CC(C)C(C)C(C)(C)C.
What is the InChIKey of 2,2,3,4,6,7,8,9-octamethyldodecane?
The InChIKey is UWXNBQGTMYPVRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42/c1-11-12-14(2)17(5)18(6)15(3)13-16(4)19(7)20(8,9)10/h14-19H,11-13H2,1-10H3.
What are the key properties of 2,2,3,4,6,7,8,9-octamethyldodecane?
2,2,3,4,6,7,8,9-octamethyldodecane has a molecular weight of 282.56 g/mol, XLogP of 7.04, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,4,6,7,8,9-octamethyldodecane is sourced from PubChem (CID 123701527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).