2,3,4,5-tetramethyl-6-methylsulfanyloxane

C10H20OS — CID 20660407

IUPAC2,3,4,5-tetramethyl-6-methylsulfanyloxane
SMILESCSC1OC(C)C(C)C(C)C1C
InChIInChI=1S/C10H20OS/c1-6-7(2)9(4)11-10(12-5)8(6)3/h6-10H,1-5H3
InChIKeyXMXLRTYWQOLMFL-UHFFFAOYSA-N
MW188.34 g/mol
LogP3.00
Rot. Bonds1

About 2,3,4,5-tetramethyl-6-methylsulfanyloxane

2,3,4,5-tetramethyl-6-methylsulfanyloxane (PubChem CID 20660407) has the molecular formula C10H20OS and a molecular weight of 188.34 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-6-methylsulfanyloxane.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-6-methylsulfanyloxane
PubChem CID20660407
Molecular FormulaC10H20OS
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name2,3,4,5-tetramethyl-6-methylsulfanyloxane
SMILESCSC1OC(C)C(C)C(C)C1C
InChIInChI=1S/C10H20OS/c1-6-7(2)9(4)11-10(12-5)8(6)3/h6-10H,1-5H3
InChIKeyXMXLRTYWQOLMFL-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,6R)-5-fluoro-2,3,4-trimethyl-6-methylsulfanyloxane
CID 54472325
(3S)-5-fluoro-2,3,4-trimethyl-6-methylsulfanyloxane
CID 54472326
(2R,4R,5S)-2,3,4,5-tetramethyl-6-(trifluoromethylsulfanylmethyl)oxane
CID 71076117
(4R)-4-methyl-2-(2-methyl-1-methylsulfanylpropyl)oxane
CID 137537232
5-(3-Methylbutyl)-2-propyl-1,3-oxathiane
CID 12329615
3,4,5-Trimethyl-2-methylsulfanyl-6-propan-2-yloxane
CID 20660408
4-Ethylsulfanyl-3-propyloxane
CID 53778399
3-[(2-Methyloxan-4-yl)methylsulfanyl]propan-1-ol
CID 53940170
3-Ethyl-4-ethylsulfanyloxane
CID 54391009
2-(3-Methylbutyl)-4-propyl-1,3-oxathiane
CID 57958757
2-(5,6-dihydro-4H-1,3-dithiin-1-ium-2-yl)-5-methyloxane
CID 57987738
1-Methylidene-4-(3-propan-2-yloxypropyl)thiane 1-oxide
CID 58377365

Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-6-methylsulfanyloxane?
The IUPAC name of 2,3,4,5-tetramethyl-6-methylsulfanyloxane (CID 20660407) is 2,3,4,5-tetramethyl-6-methylsulfanyloxane.
What is the SMILES notation for 2,3,4,5-tetramethyl-6-methylsulfanyloxane?
The canonical SMILES for 2,3,4,5-tetramethyl-6-methylsulfanyloxane is CSC1OC(C)C(C)C(C)C1C.
What is the InChIKey of 2,3,4,5-tetramethyl-6-methylsulfanyloxane?
The InChIKey is XMXLRTYWQOLMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OS/c1-6-7(2)9(4)11-10(12-5)8(6)3/h6-10H,1-5H3.
What are the key properties of 2,3,4,5-tetramethyl-6-methylsulfanyloxane?
2,3,4,5-tetramethyl-6-methylsulfanyloxane has a molecular weight of 188.34 g/mol, XLogP of 3.00, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-6-methylsulfanyloxane is sourced from PubChem (CID 20660407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).