2-[[(S)-methylsulfinyl]methyl]furan

C6H8O2S — CID 119098303

IUPAC2-[[(S)-methylsulfinyl]methyl]furan
SMILESC[S@](=O)Cc1ccco1
InChIInChI=1S/C6H8O2S/c1-9(7)5-6-3-2-4-8-6/h2-4H,5H2,1H3/t9-/m0/s1
InChIKeyRVBNVHBRYODBLU-VIFPVBQESA-N
MW144.19 g/mol
LogP1.16
Rot. Bonds2

About 2-[[(S)-methylsulfinyl]methyl]furan

2-[[(S)-methylsulfinyl]methyl]furan (PubChem CID 119098303) has the molecular formula C6H8O2S and a molecular weight of 144.19 g/mol. Its IUPAC name is 2-[[(S)-methylsulfinyl]methyl]furan.

Molecular Properties

Compound Name2-[[(S)-methylsulfinyl]methyl]furan
PubChem CID119098303
Molecular FormulaC6H8O2S
Molecular Weight144.19 g/mol
Exact Mass144.02
IUPAC Name2-[[(S)-methylsulfinyl]methyl]furan
SMILESC[S@](=O)Cc1ccco1
InChIInChI=1S/C6H8O2S/c1-9(7)5-6-3-2-4-8-6/h2-4H,5H2,1H3/t9-/m0/s1
InChIKeyRVBNVHBRYODBLU-VIFPVBQESA-N
XLogP1.16
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

furan-2-ylmethanethiol;methylsulfinylmethane
CID 174344975
2-(furan-2-ylmethylsulfinylsulfanylmethyl)furan
CID 71576322
2-[[methyl(sulfinato)amino]methyl]furan
CID 57032759
furan-2-ylmethanethiol
CID 158949317
[4-(furan-2-ylmethyl)piperazin-1-yl]-[3-[[(S)-methylsulfinyl]methyl]phenyl]methanone
CID 94536612
acetaldehyde;2-(chloromethyl)furan
CID 174376101
2-(2-deuterioethyl)furan
CID 141162489
ethane;2-(methoxymethyl)furan
CID 143640700
2-(ethylperoxymethyl)furan
CID 175094388
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
2-(1-deuteriopropyl)furan
CID 141109691
furan-2-ylmethanamine;methane
CID 20976999

Frequently Asked Questions

What is the IUPAC name of 2-[[(S)-methylsulfinyl]methyl]furan?
The IUPAC name of 2-[[(S)-methylsulfinyl]methyl]furan (CID 119098303) is 2-[[(S)-methylsulfinyl]methyl]furan.
What is the SMILES notation for 2-[[(S)-methylsulfinyl]methyl]furan?
The canonical SMILES for 2-[[(S)-methylsulfinyl]methyl]furan is C[S@](=O)Cc1ccco1.
What is the InChIKey of 2-[[(S)-methylsulfinyl]methyl]furan?
The InChIKey is RVBNVHBRYODBLU-VIFPVBQESA-N. The full InChI is InChI=1S/C6H8O2S/c1-9(7)5-6-3-2-4-8-6/h2-4H,5H2,1H3/t9-/m0/s1.
What are the key properties of 2-[[(S)-methylsulfinyl]methyl]furan?
2-[[(S)-methylsulfinyl]methyl]furan has a molecular weight of 144.19 g/mol, XLogP of 1.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(S)-methylsulfinyl]methyl]furan is sourced from PubChem (CID 119098303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).