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115825-13-3 | 2H-Thiopyran, dihydro- (9CI)
CAS No: 115825-13-3 Catalog No: AG000GWJ MDL No:
Product Description
Catalog Number:
AG000GWJ
Chemical Name:
2H-Thiopyran, dihydro- (9CI)
CAS Number:
115825-13-3
Molecular Formula:
C5H8S
Molecular Weight:
100.1820
IUPAC Name:
3,4-dihydro-2H-thiopyran
InChI:
InChI=1S/C5H8S/c1-2-4-6-5-3-1/h2,4H,1,3,5H2
InChI Key:
ATVJJNGVPSKBGO-UHFFFAOYSA-N
SMILES:
C1CSC=CC1
NSC Number:
191835
Properties
Complexity:
57
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.035g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
100.179g/mol
Monoisotopic Mass:
100.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Synthesis of 5-thiodidehydropyranylcytosine derivatives as potential anti-HIV agents. | Bioorganic & medicinal chemistry letters 20110601 |
| Synthesis and structure-activity studies of antibacterial oxazolidinones containing dihydrothiopyran or dihydrothiazine C-rings. | Bioorganic & medicinal chemistry letters 20060701 |
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