4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran

C14H12O2S — CID 100921942

IUPAC4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran
SMILESO=S(C1=COCC1)c1cccc2ccccc12
InChIInChI=1S/C14H12O2S/c15-17(12-8-9-16-10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10H,8-9H2
InChIKeyMONMAGAOGDRYDQ-UHFFFAOYSA-N
MW244.32 g/mol
LogP3.21
Rot. Bonds2

About 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran

4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran (PubChem CID 100921942) has the molecular formula C14H12O2S and a molecular weight of 244.32 g/mol. Its IUPAC name is 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran.

Molecular Properties

Compound Name4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran
PubChem CID100921942
Molecular FormulaC14H12O2S
Molecular Weight244.32 g/mol
Exact Mass244.06
IUPAC Name4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran
SMILESO=S(C1=COCC1)c1cccc2ccccc12
InChIInChI=1S/C14H12O2S/c15-17(12-8-9-16-10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10H,8-9H2
InChIKeyMONMAGAOGDRYDQ-UHFFFAOYSA-N
XLogP3.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran?
The IUPAC name of 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran (CID 100921942) is 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran.
What is the SMILES notation for 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran?
The canonical SMILES for 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran is O=S(C1=COCC1)c1cccc2ccccc12.
What is the InChIKey of 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran?
The InChIKey is MONMAGAOGDRYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2S/c15-17(12-8-9-16-10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10H,8-9H2.
What are the key properties of 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran?
4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran has a molecular weight of 244.32 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-ylsulfinyl-2,3-dihydrofuran is sourced from PubChem (CID 100921942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).