2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane

C14H38O3S2 — CID 160800714

IUPAC2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane
SMILESCC(C)(C)C.CCC.COC.CS(C)(=O)=O.CSC
InChIInChI=1S/C5H12.C3H8.C2H6O2S.C2H6O.C2H6S/c1-5(2,3)4;1-3-2;1-5(2,3)4;2*1-3-2/h1-4H3;3H2,1-2H3;1-2H3;2*1-2H3
InChIKeySDAMEDNWYKJICI-UHFFFAOYSA-N
MW318.59 g/mol
LogP4.37
Rot. Bonds

About 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane

2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane (PubChem CID 160800714) has the molecular formula C14H38O3S2 and a molecular weight of 318.59 g/mol. Its IUPAC name is 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane.

Molecular Properties

Compound Name2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane
PubChem CID160800714
Molecular FormulaC14H38O3S2
Molecular Weight318.59 g/mol
Exact Mass318.23
IUPAC Name2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane
SMILESCC(C)(C)C.CCC.COC.CS(C)(=O)=O.CSC
InChIInChI=1S/C5H12.C3H8.C2H6O2S.C2H6O.C2H6S/c1-5(2,3)4;1-3-2;1-5(2,3)4;2*1-3-2/h1-4H3;3H2,1-2H3;1-2H3;2*1-2H3
InChIKeySDAMEDNWYKJICI-UHFFFAOYSA-N
XLogP4.37
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.59
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

benzene;bis(2,2-dimethylpropane);ethane;bis(1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane);methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane;bis(propan-2-one)
CID 160630765
2-tert-butylsulfinyl-2-methylpropane;2-tert-butylsulfonyl-2-methylpropane;methane;methoxymethane;methylsulfanylmethane;propane
CID 161267370
1,4-ditert-butylbenzene;2,2-dimethylpropane;methylsulfonylmethane;propane
CID 157161752
dimethyl carbonate;2,2-dimethylpropane;1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methoxymethane;N-methylacetamide;methyl acetate;methyl N-methylcarbamate;2-methylpropane;methylsulfanylmethane;methylsulfonylmethane;propane;propan-2-one
CID 160563130
1-ethylsulfonylethane;methoxymethane
CID 174793539
benzene;2,2-dimethylpropane;1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfinylmethane;methylsulfonylmethane;propan-2-one
CID 160852246
2-methyl-2-methylsulfonylbutane
CID 20813325
9,9-dimethylfluorene;2,2-dimethylpropane;1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methoxymethane;methylsulfonylmethane;propane;propan-2-one
CID 159179868
benzene;ethane;methoxymethane;methylsulfanylmethane;propane;propan-2-one
CID 158612029
2,2-dimethylpropane;1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methane;methoxymethane;methylsulfonylmethane;propan-2-one
CID 158159378
dimethoxy(dimethyl)silane;N,N-dimethylmethanamine;2,2-dimethylpropane;methoxymethane;N-methylacetamide;methyl acetate;N-methylmethanamine;methyl methanesulfonate;methyl N-methylcarbamate;2-methylpropane;methylsulfanylmethane;methylsulfinylmethane;methylsulfonylmethane;propane;propan-2-one;tetramethylsilane
CID 159126287
9,9-dimethylfluorene;2,2-dimethylpropane;1,1,1,3,3,3-hexafluoro-2,2-dimethylpropane;methoxymethane;methylsulfonylmethane;propane;propan-2-one;tetramethylsilane
CID 158611595

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane?
The IUPAC name of 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane (CID 160800714) is 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane.
What is the SMILES notation for 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane?
The canonical SMILES for 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane is CC(C)(C)C.CCC.COC.CS(C)(=O)=O.CSC.
What is the InChIKey of 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane?
The InChIKey is SDAMEDNWYKJICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12.C3H8.C2H6O2S.C2H6O.C2H6S/c1-5(2,3)4;1-3-2;1-5(2,3)4;2*1-3-2/h1-4H3;3H2,1-2H3;1-2H3;2*1-2H3.
What are the key properties of 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane?
2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane has a molecular weight of 318.59 g/mol, XLogP of 4.37, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropane;methoxymethane;methylsulfanylmethane;methylsulfonylmethane;propane is sourced from PubChem (CID 160800714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).