2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane

C14H30O2 — CID 90464175

IUPAC2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane
SMILESCC(CC(C)(C)OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C14H30O2/c1-11(15-12(2,3)4)10-14(8,9)16-13(5,6)7/h11H,10H2,1-9H3
InChIKeyCFHHRAWATFPAJZ-UHFFFAOYSA-N
MW230.39 g/mol
LogP4.17
Rot. Bonds4

About 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane

2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane (PubChem CID 90464175) has the molecular formula C14H30O2 and a molecular weight of 230.39 g/mol. Its IUPAC name is 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane.

Molecular Properties

Compound Name2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane
PubChem CID90464175
Molecular FormulaC14H30O2
Molecular Weight230.39 g/mol
Exact Mass230.22
IUPAC Name2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane
SMILESCC(CC(C)(C)OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C14H30O2/c1-11(15-12(2,3)4)10-14(8,9)16-13(5,6)7/h11H,10H2,1-9H3
InChIKeyCFHHRAWATFPAJZ-UHFFFAOYSA-N
XLogP4.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.39
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane?
The IUPAC name of 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane (CID 90464175) is 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane.
What is the SMILES notation for 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane?
The canonical SMILES for 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane is CC(CC(C)(C)OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane?
The InChIKey is CFHHRAWATFPAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2/c1-11(15-12(2,3)4)10-14(8,9)16-13(5,6)7/h11H,10H2,1-9H3.
What are the key properties of 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane?
2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane has a molecular weight of 230.39 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]pentane is sourced from PubChem (CID 90464175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).