4-(5-Isoxazolyl)-2-thiophenesulfonyl chloride - CAS 1060817-63-1
Catalog: |
BB001819 |
Product Name: |
4-(5-Isoxazolyl)-2-thiophenesulfonyl chloride |
CAS: |
1060817-63-1 |
Synonyms: |
4-(1,2-oxazol-5-yl)thiophene-2-sulfonyl chloride |
IUPAC Name: | 4-(1,2-oxazol-5-yl)thiophene-2-sulfonyl chloride |
Description: | 4-(5-Isoxazolyl)-2-thiophenesulfonyl chloride (CAS# 1060817-63-1) is a useful research chemical. |
Molecular Weight: | 249.69 |
Molecular Formula: | C7H4ClNO3S2 |
Canonical SMILES: | C1=C(ON=C1)C2=CSC(=C2)S(=O)(=O)Cl |
InChI: | InChI=1S/C7H4ClNO3S2/c8-14(10,11)7-3-5(4-13-7)6-1-2-9-12-6/h1-4H |
InChI Key: | BJBJAMREHYSGCC-UHFFFAOYSA-N |
LogP: | 3.41140 |
Complexity: | 303 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.932113 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.932113 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 96.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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