| CAS Number | 33622-50-3 |
| Catalog Number | AG0037LU(AGN-PC-0LUOS7) |
| Chemical Name | Dimethyl 3,3'-sulfinyldipropionate |
| IUPAC Name | methyl 3-(3-methoxy-3-oxopropyl)sulfinylpropanoate |
| InChI | InChI=1S/C8H14O5S/c1-12-7(9)3-5-14(11)6-4-8(10)13-2/h3-6H2,1-2H3 |
| InChI Key | GLPRQNOWBCEZRE-UHFFFAOYSA-N |
| MDL Number | MFCD00810275 |
| Molecular Formula | C8H14O5S |
| Molecular Weight | 222.2588 |
| SMILES | S(=O)(CCC(=O)OC)CCC(=O)OC |
| Synonyms | Dimethyl 3,3'-sulfinyldipropionate,
33622-50-3,
Propanoic acid, 3,3'-sulfinylbis-, dimethyl ester,
CBDivE_016086,
AC1O7NPI,
CTK1B1635,
DTXSID90425041,
MFCD00810275,
AKOS030228067,
KS-000001C6,
3,3'-Sulfinylbis(propanoic acid methyl) ester,
methyl 3-(3-methoxy-3-oxopropyl)sulfinylpropanoate,
dimethyl 3,3'-sulfinyldipropanoate,
CID6612577,
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| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.255g/mol |
| Monoisotopic Mass | 222.056g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 88.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number