(4R,8R)-2,4,6,8,10-pentamethylundecane

C16H34 — CID 134836322

IUPAC(4R,8R)-2,4,6,8,10-pentamethylundecane
SMILESCC(C)C[C@@H](C)CC(C)C[C@H](C)CC(C)C
InChIInChI=1S/C16H34/c1-12(2)8-14(5)10-16(7)11-15(6)9-13(3)4/h12-16H,8-11H2,1-7H3/t14-,15-/m1/s1
InChIKeyRUSQGTLQXKWMAF-HUUCEWRRSA-N
MW226.45 g/mol
LogP5.77
Rot. Bonds8

About (4R,8R)-2,4,6,8,10-pentamethylundecane

(4R,8R)-2,4,6,8,10-pentamethylundecane (PubChem CID 134836322) has the molecular formula C16H34 and a molecular weight of 226.45 g/mol. Its IUPAC name is (4R,8R)-2,4,6,8,10-pentamethylundecane.

Molecular Properties

Compound Name(4R,8R)-2,4,6,8,10-pentamethylundecane
PubChem CID134836322
Molecular FormulaC16H34
Molecular Weight226.45 g/mol
Exact Mass226.27
IUPAC Name(4R,8R)-2,4,6,8,10-pentamethylundecane
SMILESCC(C)C[C@@H](C)CC(C)C[C@H](C)CC(C)C
InChIInChI=1S/C16H34/c1-12(2)8-14(5)10-16(7)11-15(6)9-13(3)4/h12-16H,8-11H2,1-7H3/t14-,15-/m1/s1
InChIKeyRUSQGTLQXKWMAF-HUUCEWRRSA-N
XLogP5.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500226.45
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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acetylene;2,4,6-trimethylheptane
CID 144531255
2,4,6,8-tetramethyldecane
CID 54224604
(2S,4R)-2,4,6-trimethylheptan-1-ol
CID 13109020
2,4,6,8,10,12,14-heptamethylheptadecane
CID 91613417
2,4,6,8,10,12-hexamethylpentadecane
CID 15607000
2,4,6,8,10-pentamethyltridecane
CID 20715673
3,5,7-trimethyloctan-1-amine
CID 89355702
2,7-dimethyloctane;2,4,6-trimethylheptane
CID 160877277
(4S)-2,4-dimethylhexane
CID 22810193
2,4-dimethylpentane
CID 157050020

Frequently Asked Questions

What is the IUPAC name of (4R,8R)-2,4,6,8,10-pentamethylundecane?
The IUPAC name of (4R,8R)-2,4,6,8,10-pentamethylundecane (CID 134836322) is (4R,8R)-2,4,6,8,10-pentamethylundecane.
What is the SMILES notation for (4R,8R)-2,4,6,8,10-pentamethylundecane?
The canonical SMILES for (4R,8R)-2,4,6,8,10-pentamethylundecane is CC(C)C[C@@H](C)CC(C)C[C@H](C)CC(C)C.
What is the InChIKey of (4R,8R)-2,4,6,8,10-pentamethylundecane?
The InChIKey is RUSQGTLQXKWMAF-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H34/c1-12(2)8-14(5)10-16(7)11-15(6)9-13(3)4/h12-16H,8-11H2,1-7H3/t14-,15-/m1/s1.
What are the key properties of (4R,8R)-2,4,6,8,10-pentamethylundecane?
(4R,8R)-2,4,6,8,10-pentamethylundecane has a molecular weight of 226.45 g/mol, XLogP of 5.77, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,8R)-2,4,6,8,10-pentamethylundecane is sourced from PubChem (CID 134836322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).