| CAS Number | 6462-50-6 |
| Catalog Number | AG01BC7L(AGN-PC-0TDAW4) |
| Chemical Name | Sodium 4-methoxybenzene-1-sulfinate |
| IUPAC Name | sodium;4-methoxybenzenesulfinate |
| InChI | InChI=1S/C7H8O3S.Na/c1-10-6-2-4-7(5-3-6)11(8)9;/h2-5H,1H3,(H,8,9);/q;+1/p-1 |
| InChI Key | JZEDOEPVMYKFAB-UHFFFAOYSA-M |
| MDL Number | MFCD00050888 |
| Molecular Formula | C7H7NaO3S |
| Molecular Weight | 194.1835 |
| SMILES | COC1=CC=C(S(O[Na])=O)C=C1 |
| Synonyms | Sodium 4-methoxybenzene-1-sulfinate,
6462-50-6,
Sodium 4-methoxybenzenesulfinate,
SCHEMBL357932,
Sodium 4-methoxyphenylsulfinate,
sodium p-methoxybenzenesulfinate,
Sodium 4-methoxy-benzenesulfinate,
JZEDOEPVMYKFAB-UHFFFAOYSA-M,
AKOS016373536,
AKOS022191661,
4-Methoxybenzenesulfinic acid sodium salt,
CID11367554,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.18g/mol |
| Monoisotopic Mass | 194.001g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number