2-methoxy-2-methylpropane;thionyl dichloride

C5H12Cl2O2S — CID 87282142

IUPAC2-methoxy-2-methylpropane;thionyl dichloride
SMILESCOC(C)(C)C.O=S(Cl)Cl
InChIInChI=1S/C5H12O.Cl2OS/c1-5(2,3)6-4;1-4(2)3/h1-4H3;
InChIKeyYCTYKUBUGGBFMB-UHFFFAOYSA-N
MW207.12 g/mol
LogP2.47
Rot. Bonds

About 2-methoxy-2-methylpropane;thionyl dichloride

2-methoxy-2-methylpropane;thionyl dichloride (PubChem CID 87282142) has the molecular formula C5H12Cl2O2S and a molecular weight of 207.12 g/mol. Its IUPAC name is 2-methoxy-2-methylpropane;thionyl dichloride.

Molecular Properties

Compound Name2-methoxy-2-methylpropane;thionyl dichloride
PubChem CID87282142
Molecular FormulaC5H12Cl2O2S
Molecular Weight207.12 g/mol
Exact Mass205.99
IUPAC Name2-methoxy-2-methylpropane;thionyl dichloride
SMILESCOC(C)(C)C.O=S(Cl)Cl
InChIInChI=1S/C5H12O.Cl2OS/c1-5(2,3)6-4;1-4(2)3/h1-4H3;
InChIKeyYCTYKUBUGGBFMB-UHFFFAOYSA-N
XLogP2.47
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.12
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methylpropane;thionyl dichloride?
The IUPAC name of 2-methoxy-2-methylpropane;thionyl dichloride (CID 87282142) is 2-methoxy-2-methylpropane;thionyl dichloride.
What is the SMILES notation for 2-methoxy-2-methylpropane;thionyl dichloride?
The canonical SMILES for 2-methoxy-2-methylpropane;thionyl dichloride is COC(C)(C)C.O=S(Cl)Cl.
What is the InChIKey of 2-methoxy-2-methylpropane;thionyl dichloride?
The InChIKey is YCTYKUBUGGBFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.Cl2OS/c1-5(2,3)6-4;1-4(2)3/h1-4H3;.
What are the key properties of 2-methoxy-2-methylpropane;thionyl dichloride?
2-methoxy-2-methylpropane;thionyl dichloride has a molecular weight of 207.12 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methylpropane;thionyl dichloride is sourced from PubChem (CID 87282142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).