1-(methoxymethyl)-1-methylsulfanylcyclopropane

C6H12OS — CID 123710643

IUPAC1-(methoxymethyl)-1-methylsulfanylcyclopropane
SMILESCOCC1(SC)CC1
InChIInChI=1S/C6H12OS/c1-7-5-6(8-2)3-4-6/h3-5H2,1-2H3
InChIKeyWMYYGWOBNKQQCI-UHFFFAOYSA-N
MW132.23 g/mol
LogP1.53
Rot. Bonds3

About 1-(methoxymethyl)-1-methylsulfanylcyclopropane

1-(methoxymethyl)-1-methylsulfanylcyclopropane (PubChem CID 123710643) has the molecular formula C6H12OS and a molecular weight of 132.23 g/mol. Its IUPAC name is 1-(methoxymethyl)-1-methylsulfanylcyclopropane.

Molecular Properties

Compound Name1-(methoxymethyl)-1-methylsulfanylcyclopropane
PubChem CID123710643
Molecular FormulaC6H12OS
Molecular Weight132.23 g/mol
Exact Mass132.06
IUPAC Name1-(methoxymethyl)-1-methylsulfanylcyclopropane
SMILESCOCC1(SC)CC1
InChIInChI=1S/C6H12OS/c1-7-5-6(8-2)3-4-6/h3-5H2,1-2H3
InChIKeyWMYYGWOBNKQQCI-UHFFFAOYSA-N
XLogP1.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.23
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethoxy-1-methylsulfanylcyclopropane
CID 12662482
Butyraldehyde dimethyl thioacetal
CID 129804412
2-Methoxyethylsulfanylcyclopropane
CID 52141661
1-Methoxy-4-methylsulfanylbutane
CID 88910080
2-Methoxyethylsulfanylmethylcyclopropane
CID 89892525
2-Methylsulfanylethoxymethylcyclopropane
CID 103709697
1-Methylsulfanyl-2-(sulfanyloxymethyl)cyclopropane
CID 123504637
1-Methoxy-3-methyl-3-methylsulfanylbutane
CID 102301237
Ethoxymethylsulfanylmethylcyclopropane
CID 131067555

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-1-methylsulfanylcyclopropane?
The IUPAC name of 1-(methoxymethyl)-1-methylsulfanylcyclopropane (CID 123710643) is 1-(methoxymethyl)-1-methylsulfanylcyclopropane.
What is the SMILES notation for 1-(methoxymethyl)-1-methylsulfanylcyclopropane?
The canonical SMILES for 1-(methoxymethyl)-1-methylsulfanylcyclopropane is COCC1(SC)CC1.
What is the InChIKey of 1-(methoxymethyl)-1-methylsulfanylcyclopropane?
The InChIKey is WMYYGWOBNKQQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OS/c1-7-5-6(8-2)3-4-6/h3-5H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-1-methylsulfanylcyclopropane?
1-(methoxymethyl)-1-methylsulfanylcyclopropane has a molecular weight of 132.23 g/mol, XLogP of 1.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-1-methylsulfanylcyclopropane is sourced from PubChem (CID 123710643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).