3-(2-Thienyl)-1,2,5-oxadiazole - CAS 127219-88-9
Catalog: |
BB006745 |
Product Name: |
3-(2-Thienyl)-1,2,5-oxadiazole |
CAS: |
127219-88-9 |
Synonyms: |
3-thiophen-2-yl-1,2,5-oxadiazole; 3-thiophen-2-yl-1,2,5-oxadiazole |
IUPAC Name: | 3-thiophen-2-yl-1,2,5-oxadiazole |
Description: | 3-(2-Thienyl)-1,2,5-oxadiazole (CAS# 127219-88-9 ) is a useful research chemical. |
Molecular Weight: | 152.17 |
Molecular Formula: | C6H4N2OS |
Canonical SMILES: | C1=CSC(=C1)C2=NON=C2 |
InChI: | InChI=1S/C6H4N2OS/c1-2-6(10-3-1)5-4-7-9-8-5/h1-4H |
InChI Key: | CNIITXLGGMHRPE-UHFFFAOYSA-N |
LogP: | 1.79810 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.00443393 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.00443393 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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