2-methoxy-2,3,5,5-tetramethylhexane

C11H24O — CID 12756032

IUPAC2-methoxy-2,3,5,5-tetramethylhexane
SMILESCOC(C)(C)C(C)CC(C)(C)C
InChIInChI=1S/C11H24O/c1-9(8-10(2,3)4)11(5,6)12-7/h9H,8H2,1-7H3
InChIKeyWOJCICGYUCVXTI-UHFFFAOYSA-N
MW172.31 g/mol
LogP3.48
Rot. Bonds3

About 2-methoxy-2,3,5,5-tetramethylhexane

2-methoxy-2,3,5,5-tetramethylhexane (PubChem CID 12756032) has the molecular formula C11H24O and a molecular weight of 172.31 g/mol. Its IUPAC name is 2-methoxy-2,3,5,5-tetramethylhexane.

Molecular Properties

Compound Name2-methoxy-2,3,5,5-tetramethylhexane
PubChem CID12756032
Molecular FormulaC11H24O
Molecular Weight172.31 g/mol
Exact Mass172.18
IUPAC Name2-methoxy-2,3,5,5-tetramethylhexane
SMILESCOC(C)(C)C(C)CC(C)(C)C
InChIInChI=1S/C11H24O/c1-9(8-10(2,3)4)11(5,6)12-7/h9H,8H2,1-7H3
InChIKeyWOJCICGYUCVXTI-UHFFFAOYSA-N
XLogP3.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.31
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2,3,5,5-tetramethylhexane?
The IUPAC name of 2-methoxy-2,3,5,5-tetramethylhexane (CID 12756032) is 2-methoxy-2,3,5,5-tetramethylhexane.
What is the SMILES notation for 2-methoxy-2,3,5,5-tetramethylhexane?
The canonical SMILES for 2-methoxy-2,3,5,5-tetramethylhexane is COC(C)(C)C(C)CC(C)(C)C.
What is the InChIKey of 2-methoxy-2,3,5,5-tetramethylhexane?
The InChIKey is WOJCICGYUCVXTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O/c1-9(8-10(2,3)4)11(5,6)12-7/h9H,8H2,1-7H3.
What are the key properties of 2-methoxy-2,3,5,5-tetramethylhexane?
2-methoxy-2,3,5,5-tetramethylhexane has a molecular weight of 172.31 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2,3,5,5-tetramethylhexane is sourced from PubChem (CID 12756032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).