methane;tris(2-methyl-2-propoxypropane)

C22H52O3 — CID 160767059

IUPACmethane;tris(2-methyl-2-propoxypropane)
SMILESC.CCCOC(C)(C)C.CCCOC(C)(C)C.CCCOC(C)(C)C
InChIInChI=1S/3C7H16O.CH4/c3*1-5-6-8-7(2,3)4;/h3*5-6H2,1-4H3;1H4
InChIKeyRYUWPJVYVICGEY-UHFFFAOYSA-N
MW364.66 g/mol
LogP7.27
Rot. Bonds6

About methane;tris(2-methyl-2-propoxypropane)

methane;tris(2-methyl-2-propoxypropane) (PubChem CID 160767059) has the molecular formula C22H52O3 and a molecular weight of 364.66 g/mol. Its IUPAC name is methane;tris(2-methyl-2-propoxypropane).

Molecular Properties

Compound Namemethane;tris(2-methyl-2-propoxypropane)
PubChem CID160767059
Molecular FormulaC22H52O3
Molecular Weight364.66 g/mol
Exact Mass364.39
IUPAC Namemethane;tris(2-methyl-2-propoxypropane)
SMILESC.CCCOC(C)(C)C.CCCOC(C)(C)C.CCCOC(C)(C)C
InChIInChI=1S/3C7H16O.CH4/c3*1-5-6-8-7(2,3)4;/h3*5-6H2,1-4H3;1H4
InChIKeyRYUWPJVYVICGEY-UHFFFAOYSA-N
XLogP7.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.66
LogP ≤ 57.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methane;tris(2-methyl-2-propoxypropane)?
The IUPAC name of methane;tris(2-methyl-2-propoxypropane) (CID 160767059) is methane;tris(2-methyl-2-propoxypropane).
What is the SMILES notation for methane;tris(2-methyl-2-propoxypropane)?
The canonical SMILES for methane;tris(2-methyl-2-propoxypropane) is C.CCCOC(C)(C)C.CCCOC(C)(C)C.CCCOC(C)(C)C.
What is the InChIKey of methane;tris(2-methyl-2-propoxypropane)?
The InChIKey is RYUWPJVYVICGEY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C7H16O.CH4/c3*1-5-6-8-7(2,3)4;/h3*5-6H2,1-4H3;1H4.
What are the key properties of methane;tris(2-methyl-2-propoxypropane)?
methane;tris(2-methyl-2-propoxypropane) has a molecular weight of 364.66 g/mol, XLogP of 7.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;tris(2-methyl-2-propoxypropane) is sourced from PubChem (CID 160767059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).