4-ethyl-2,3,6,8-tetramethylnonane

C15H32 — CID 123780298

IUPAC4-ethyl-2,3,6,8-tetramethylnonane
SMILESCCC(CC(C)CC(C)C)C(C)C(C)C
InChIInChI=1S/C15H32/c1-8-15(14(7)12(4)5)10-13(6)9-11(2)3/h11-15H,8-10H2,1-7H3
InChIKeyAIQCOKXZEVCXOY-UHFFFAOYSA-N
MW212.42 g/mol
LogP5.38
Rot. Bonds7

About 4-ethyl-2,3,6,8-tetramethylnonane

4-ethyl-2,3,6,8-tetramethylnonane (PubChem CID 123780298) has the molecular formula C15H32 and a molecular weight of 212.42 g/mol. Its IUPAC name is 4-ethyl-2,3,6,8-tetramethylnonane.

Molecular Properties

Compound Name4-ethyl-2,3,6,8-tetramethylnonane
PubChem CID123780298
Molecular FormulaC15H32
Molecular Weight212.42 g/mol
Exact Mass212.25
IUPAC Name4-ethyl-2,3,6,8-tetramethylnonane
SMILESCCC(CC(C)CC(C)C)C(C)C(C)C
InChIInChI=1S/C15H32/c1-8-15(14(7)12(4)5)10-13(6)9-11(2)3/h11-15H,8-10H2,1-7H3
InChIKeyAIQCOKXZEVCXOY-UHFFFAOYSA-N
XLogP5.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.42
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-ethyl-2,3,4,7-tetramethyloctane
CID 57492474
propane;2,4,6-trimethylheptane
CID 165013878
2,4,6,8-tetramethyldecane
CID 54224604
(4S)-2,4-dimethylhexane
CID 22810193
2,4,6,8,10,12,14,16,18,20-decamethylhenicosane
CID 123384520
(4R,8R)-2,4,6,8,10-pentamethylundecane
CID 134836322
7-ethyl-2,3,6,9-tetramethyl-4-propyldecane
CID 171102874
bis(3-ethyl-2,5-dimethylhexane);2,3,5-trimethylhexane
CID 158124922
4,6-diethyl-2,3,9-trimethyldodecane
CID 123599024
(4R)-2,4-dimethylhexane;methane
CID 157133469
5-ethyl-2,3,4-trimethylheptane
CID 53428868
2,4-dimethylhexane;propane
CID 143348383

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,3,6,8-tetramethylnonane?
The IUPAC name of 4-ethyl-2,3,6,8-tetramethylnonane (CID 123780298) is 4-ethyl-2,3,6,8-tetramethylnonane.
What is the SMILES notation for 4-ethyl-2,3,6,8-tetramethylnonane?
The canonical SMILES for 4-ethyl-2,3,6,8-tetramethylnonane is CCC(CC(C)CC(C)C)C(C)C(C)C.
What is the InChIKey of 4-ethyl-2,3,6,8-tetramethylnonane?
The InChIKey is AIQCOKXZEVCXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32/c1-8-15(14(7)12(4)5)10-13(6)9-11(2)3/h11-15H,8-10H2,1-7H3.
What are the key properties of 4-ethyl-2,3,6,8-tetramethylnonane?
4-ethyl-2,3,6,8-tetramethylnonane has a molecular weight of 212.42 g/mol, XLogP of 5.38, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,3,6,8-tetramethylnonane is sourced from PubChem (CID 123780298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).