| CAS Number | 869885-60-9 |
| Catalog Number | AG00GSOA(AGN-PC-09RO4U) |
| Chemical Name | Benzofuran-5-ylmethanesulfonyl chloride |
| IUPAC Name | 1-benzofuran-5-sulfonyl chloride |
| InChI | InChI=1S/C8H5ClO3S/c9-13(10,11)7-1-2-8-6(5-7)3-4-12-8/h1-5H |
| InChI Key | DXQKXPTYOGEXEN-UHFFFAOYSA-N |
| MDL Number | MFCD11053679 |
| Molecular Formula | C8H5ClO3S |
| Molecular Weight | 216.6415 |
| SMILES | O=S(C1=CC=C(OC=C2)C2=C1)(Cl)=O |
| Synonyms | BENZOFURAN-5-SULFONYL CHLORIDE,
869885-60-9,
1-benzofuran-5-sulfonyl chloride,
AK310812,
5-Benzofuransulfonylchloride,
5-Benzofuransulfonyl chloride,
SCHEMBL692366,
KS-00000FPI,
DTXSID70695124,
benzo[b]furan-5-sulfonyl chloride,
DXQKXPTYOGEXEN-UHFFFAOYSA-N,
FCH926275,
MFCD11053679,
ZINC59804040,
AKOS006337108,
AS-37976,
AX8115760,
A-1795,
Benzofuran-5-ylmethanesulfonylchloride,
BENZOFURAN-5-YLMETHANESULFONYL CHLORIDE,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.635g/mol |
| Monoisotopic Mass | 215.965g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number