| CAS Number | 848178-48-3 |
| Catalog Number | AG00IDG9(AGN-PC-0WBKBM) |
| Chemical Name | 3-(Morpholin-4-ylsulfonyl)propanoic acid |
| IUPAC Name | 3-morpholin-4-ylsulfonylpropanoic acid |
| InChI | InChI=1S/C7H13NO5S/c9-7(10)1-6-14(11,12)8-2-4-13-5-3-8/h1-6H2,(H,9,10) |
| InChI Key | BXZBRLVPYVFGDN-UHFFFAOYSA-N |
| MDL Number | MFCD07323647 |
| Molecular Formula | C7H13NO5S |
| Molecular Weight | 223.2468 |
| SMILES | OC(CCS(N1CCOCC1)(=O)=O)=O |
| Synonyms | 3-(morpholine-4-sulfonyl)propanoic acid,
848178-48-3,
3-(morpholin-4-ylsulfonyl)propanoic acid,
3-(4-Morpholinylsulfonyl)propanoic acid,
3-morpholin-4-ylsulfonylpropanoic Acid,
AC1NLR29,
AC1Q75QI,
CTK7J4588,
HMS1746P02,
ZINC4207164,
MFCD07323647,
AKOS000118339,
MCULE-6742942613,
NE23108,
NS-02738,
EN300-13924,
Z94599214,
CID4962731,
|
| Complexity | 288 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.243g/mol |
| Monoisotopic Mass | 223.051g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 92.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number