5-ethoxy-2,3-dihydrothiophene

C6H10OS — CID 141120797

IUPAC5-ethoxy-2,3-dihydrothiophene
SMILESCCOC1=CCCS1
InChIInChI=1S/C6H10OS/c1-2-7-6-4-3-5-8-6/h4H,2-3,5H2,1H3
InChIKeyKQXNBBUEIFFBRP-UHFFFAOYSA-N
MW130.21 g/mol
LogP2.00
Rot. Bonds2

About 5-ethoxy-2,3-dihydrothiophene

5-ethoxy-2,3-dihydrothiophene (PubChem CID 141120797) has the molecular formula C6H10OS and a molecular weight of 130.21 g/mol. Its IUPAC name is 5-ethoxy-2,3-dihydrothiophene.

Molecular Properties

Compound Name5-ethoxy-2,3-dihydrothiophene
PubChem CID141120797
Molecular FormulaC6H10OS
Molecular Weight130.21 g/mol
Exact Mass130.05
IUPAC Name5-ethoxy-2,3-dihydrothiophene
SMILESCCOC1=CCCS1
InChIInChI=1S/C6H10OS/c1-2-7-6-4-3-5-8-6/h4H,2-3,5H2,1H3
InChIKeyKQXNBBUEIFFBRP-UHFFFAOYSA-N
XLogP2.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
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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Related Compounds

2,3-Dihydrofuranyl ethyl sulfide
CID 129671338
(Z)-1-ethoxy-1-ethylsulfanylprop-1-ene
CID 134987287
2-Methoxy-2,3-dihydrothiophene
CID 18975119
3-Ethyl-1,4-oxathiine
CID 57188038
(2Z)-2-ethylidene-1,3-oxathiolane
CID 57901503
4-Tert-butyl-1,3-oxathiole
CID 58408004
2-Methylsulfanyl-2,3-dihydrofuran
CID 66827287
4-Ethyl-1,3-oxathiole
CID 68258214
4-Methoxy-2,3-dihydrothiophene
CID 70281676
2-Ethylidene-1,3-oxathiolane
CID 76636250
3-Methylsulfanyl-2,3-dihydrofuran
CID 123921746
3-Methyl-2-methylsulfanyl-2,3-dihydrofuran
CID 126520471

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2,3-dihydrothiophene?
The IUPAC name of 5-ethoxy-2,3-dihydrothiophene (CID 141120797) is 5-ethoxy-2,3-dihydrothiophene.
What is the SMILES notation for 5-ethoxy-2,3-dihydrothiophene?
The canonical SMILES for 5-ethoxy-2,3-dihydrothiophene is CCOC1=CCCS1.
What is the InChIKey of 5-ethoxy-2,3-dihydrothiophene?
The InChIKey is KQXNBBUEIFFBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10OS/c1-2-7-6-4-3-5-8-6/h4H,2-3,5H2,1H3.
What are the key properties of 5-ethoxy-2,3-dihydrothiophene?
5-ethoxy-2,3-dihydrothiophene has a molecular weight of 130.21 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2,3-dihydrothiophene is sourced from PubChem (CID 141120797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).