| CAS Number | 1261760-59-1 |
| Catalog Number | AG01C3BN |
| Chemical Name | 2-Hydroxy-5-nitrobenzene-1-sulfonyl chloride |
| IUPAC Name | 2-hydroxy-5-nitrobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H4ClNO5S/c7-14(12,13)6-3-4(8(10)11)1-2-5(6)9/h1-3,9H |
| InChI Key | YGZAEQDOCPIUPR-UHFFFAOYSA-N |
| MDL Number | MFCD18397336 |
| Molecular Formula | C6H4ClNO5S |
| Molecular Weight | 237.6177 |
| SMILES | OC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)Cl |
| Synonyms | 2-hydroxy-5-nitrobenzene-1-sulfonyl chloride,
1261760-59-1,
AKOS006335222,
ZINC104543903,
2-hydroxy-5-nitrobenzenesulfonyl chloride,
|
| Complexity | 318 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.95g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.61g/mol |
| Monoisotopic Mass | 236.95g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 109A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number