2-methyl-2-methylsulfanyl-3H-furan

C6H10OS — CID 163192713

IUPAC2-methyl-2-methylsulfanyl-3H-furan
SMILESCSC1(C)CC=CO1
InChIInChI=1S/C6H10OS/c1-6(8-2)4-3-5-7-6/h3,5H,4H2,1-2H3
InChIKeyRLDSVUFVYLJHPZ-UHFFFAOYSA-N
MW130.21 g/mol
LogP2.00
Rot. Bonds1

About 2-methyl-2-methylsulfanyl-3H-furan

2-methyl-2-methylsulfanyl-3H-furan (PubChem CID 163192713) has the molecular formula C6H10OS and a molecular weight of 130.21 g/mol. Its IUPAC name is 2-methyl-2-methylsulfanyl-3H-furan.

Molecular Properties

Compound Name2-methyl-2-methylsulfanyl-3H-furan
PubChem CID163192713
Molecular FormulaC6H10OS
Molecular Weight130.21 g/mol
Exact Mass130.05
IUPAC Name2-methyl-2-methylsulfanyl-3H-furan
SMILESCSC1(C)CC=CO1
InChIInChI=1S/C6H10OS/c1-6(8-2)4-3-5-7-6/h3,5H,4H2,1-2H3
InChIKeyRLDSVUFVYLJHPZ-UHFFFAOYSA-N
XLogP2.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-methylsulfanyl-3H-furan?
The IUPAC name of 2-methyl-2-methylsulfanyl-3H-furan (CID 163192713) is 2-methyl-2-methylsulfanyl-3H-furan.
What is the SMILES notation for 2-methyl-2-methylsulfanyl-3H-furan?
The canonical SMILES for 2-methyl-2-methylsulfanyl-3H-furan is CSC1(C)CC=CO1.
What is the InChIKey of 2-methyl-2-methylsulfanyl-3H-furan?
The InChIKey is RLDSVUFVYLJHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10OS/c1-6(8-2)4-3-5-7-6/h3,5H,4H2,1-2H3.
What are the key properties of 2-methyl-2-methylsulfanyl-3H-furan?
2-methyl-2-methylsulfanyl-3H-furan has a molecular weight of 130.21 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-methylsulfanyl-3H-furan is sourced from PubChem (CID 163192713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).