2-methyl-1-propan-2-yloxypropane

C7H16O — CID 14671559

IUPAC2-methyl-1-propan-2-yloxypropane
SMILESCC(C)COC(C)C
InChIInChI=1S/C7H16O/c1-6(2)5-8-7(3)4/h6-7H,5H2,1-4H3
InChIKeyHIIBZFKVMXEQMR-UHFFFAOYSA-N
MW116.20 g/mol
LogP2.07
Rot. Bonds3

About 2-methyl-1-propan-2-yloxypropane

2-methyl-1-propan-2-yloxypropane (PubChem CID 14671559) has the molecular formula C7H16O and a molecular weight of 116.20 g/mol. Its IUPAC name is 2-methyl-1-propan-2-yloxypropane.

Molecular Properties

Compound Name2-methyl-1-propan-2-yloxypropane
PubChem CID14671559
Molecular FormulaC7H16O
Molecular Weight116.20 g/mol
Exact Mass116.12
IUPAC Name2-methyl-1-propan-2-yloxypropane
SMILESCC(C)COC(C)C
InChIInChI=1S/C7H16O/c1-6(2)5-8-7(3)4/h6-7H,5H2,1-4H3
InChIKeyHIIBZFKVMXEQMR-UHFFFAOYSA-N
XLogP2.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.20
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propan-2-yloxypropane?
The IUPAC name of 2-methyl-1-propan-2-yloxypropane (CID 14671559) is 2-methyl-1-propan-2-yloxypropane.
What is the SMILES notation for 2-methyl-1-propan-2-yloxypropane?
The canonical SMILES for 2-methyl-1-propan-2-yloxypropane is CC(C)COC(C)C.
What is the InChIKey of 2-methyl-1-propan-2-yloxypropane?
The InChIKey is HIIBZFKVMXEQMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O/c1-6(2)5-8-7(3)4/h6-7H,5H2,1-4H3.
What are the key properties of 2-methyl-1-propan-2-yloxypropane?
2-methyl-1-propan-2-yloxypropane has a molecular weight of 116.20 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propan-2-yloxypropane is sourced from PubChem (CID 14671559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).