| CAS Number | 52200-03-0 |
| Catalog Number | AG003JNT(AGN-PC-0JD8KA) |
| Chemical Name | 3-Methoxyphenyl methanesulfonate |
| IUPAC Name | (3-methoxyphenyl) methanesulfonate |
| InChI | InChI=1S/C8H10O4S/c1-11-7-4-3-5-8(6-7)12-13(2,9)10/h3-6H,1-2H3 |
| InChI Key | SMDKUUFVIRKUBB-UHFFFAOYSA-N |
| MDL Number | MFCD09972170 |
| Molecular Formula | C8H10O4S |
| Molecular Weight | 202.2276 |
| SMILES | COc1cccc(c1)OS(=O)(=O)C |
| Synonyms | 3-METHOXYPHENYL METHANESULFONATE,
52200-03-0,
SCHEMBL5599448,
ANW-31424,
MFCD09972170,
ZINC34752443,
Phenol,3-methoxy-,1-methanesulfonate,
Methanesulfonic acid 3-methoxyphenyl ester,
SC-62425,
3-METHOXYPHENYLMETHANESULFONATE,
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| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.224g/mol |
| Monoisotopic Mass | 202.03g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number