2,2-dimethyl-1,3-di(propan-2-yloxy)propane

C11H24O2 — CID 12698291

IUPAC2,2-dimethyl-1,3-di(propan-2-yloxy)propane
SMILESCC(C)OCC(C)(C)COC(C)C
InChIInChI=1S/C11H24O2/c1-9(2)12-7-11(5,6)8-13-10(3)4/h9-10H,7-8H2,1-6H3
InChIKeyJVQYUFQGICSWFA-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.86
Rot. Bonds6

About 2,2-dimethyl-1,3-di(propan-2-yloxy)propane

2,2-dimethyl-1,3-di(propan-2-yloxy)propane (PubChem CID 12698291) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 2,2-dimethyl-1,3-di(propan-2-yloxy)propane.

Molecular Properties

Compound Name2,2-dimethyl-1,3-di(propan-2-yloxy)propane
PubChem CID12698291
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name2,2-dimethyl-1,3-di(propan-2-yloxy)propane
SMILESCC(C)OCC(C)(C)COC(C)C
InChIInChI=1S/C11H24O2/c1-9(2)12-7-11(5,6)8-13-10(3)4/h9-10H,7-8H2,1-6H3
InChIKeyJVQYUFQGICSWFA-UHFFFAOYSA-N
XLogP2.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Diethoxy-2,2-bis(ethoxymethyl)propane
CID 313905
1,3-Diethoxybutane
CID 22489932
2,2-Bis(methoxymethyl)-1,3-dipropoxy-propane
CID 53428775
1,3-Diethoxy-2,2-dimethylpropane
CID 12698290
Isopropanol t-butylmethylether
CID 15646847
1,3-Di-t-butoxy propan
CID 18988401
2,2-Dimethyl-3-(propan-2-yloxy)propan-1-ol
CID 12698286
1-Ethoxy-3-propan-2-yloxypropane
CID 20768952
2,2-Dimethyl-1-propan-2-yloxy-3-(2,2,2-trifluoroethoxy)propane
CID 135275647
1,3-Dimethoxy-2-(methoxymethyl)-2-methylpropane
CID 554369
1,3-Bis(2,2-dimethylpropoxy)-2,2-dimethylpropane
CID 10705489
1,3-Di(propan-2-yloxy)propane
CID 13156494

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1,3-di(propan-2-yloxy)propane?
The IUPAC name of 2,2-dimethyl-1,3-di(propan-2-yloxy)propane (CID 12698291) is 2,2-dimethyl-1,3-di(propan-2-yloxy)propane.
What is the SMILES notation for 2,2-dimethyl-1,3-di(propan-2-yloxy)propane?
The canonical SMILES for 2,2-dimethyl-1,3-di(propan-2-yloxy)propane is CC(C)OCC(C)(C)COC(C)C.
What is the InChIKey of 2,2-dimethyl-1,3-di(propan-2-yloxy)propane?
The InChIKey is JVQYUFQGICSWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-9(2)12-7-11(5,6)8-13-10(3)4/h9-10H,7-8H2,1-6H3.
What are the key properties of 2,2-dimethyl-1,3-di(propan-2-yloxy)propane?
2,2-dimethyl-1,3-di(propan-2-yloxy)propane has a molecular weight of 188.31 g/mol, XLogP of 2.86, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1,3-di(propan-2-yloxy)propane is sourced from PubChem (CID 12698291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).