| CAS Number | 209592-91-6 |
| Catalog Number | AG002KBA(AGN-PC-01VD4T) |
| Chemical Name | 4-(Thiophen-2-yl)benzene-1-sulfonyl chloride |
| IUPAC Name | 4-thiophen-2-ylbenzenesulfonyl chloride |
| InChI | InChI=1S/C10H7ClO2S2/c11-15(12,13)9-5-3-8(4-6-9)10-2-1-7-14-10/h1-7H |
| InChI Key | IRDZCMUQNGEQEP-UHFFFAOYSA-N |
| MDL Number | MFCD11655569 |
| Molecular Formula | C10H7ClO2S2 |
| Molecular Weight | 258.7444 |
| SMILES | ClS(C1=CC=C(C2SC=CC=2)C=C1)(=O)=O |
| Synonyms | 4-(2-thienyl)benzenesulfonyl chloride,
209592-91-6,
Benzenesulfonyl chloride, 4-(2-thienyl)-,
MFCD11655569,
4-(Thiophen-2-yl)benzene-1-sulfonyl chloride,
4-(2-Thienyl)benzenesulfonyl chloride, 95%,
SCHEMBL4796613,
CTK0J9610,
DTXSID20593348,
IRDZCMUQNGEQEP-UHFFFAOYSA-N,
AKOS015958431,
ZINC100013841,
L-3506,
F9995-0055,
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| Complexity | 302 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.734g/mol |
| Monoisotopic Mass | 257.958g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number