| CAS Number | 20101-84-2 |
| Catalog Number | AG002D5Y(AGN-PC-0LBHBY) |
| Chemical Name | 2-[(2-Hydroxyethyl)thio]acetamide |
| IUPAC Name | 2-(2-hydroxyethylsulfanyl)acetamide |
| InChI | InChI=1S/C4H9NO2S/c5-4(7)3-8-2-1-6/h6H,1-3H2,(H2,5,7) |
| InChI Key | OXASESSZXSXIFI-UHFFFAOYSA-N |
| MDL Number | MFCD04344219 |
| Molecular Formula | C4H9NO2S |
| Molecular Weight | 135.1848 |
| SMILES | NC(=O)CSCCO |
| Synonyms | 20101-84-2,
2-[(2-hydroxyethyl)thio]acetamide,
2-((2-Hydroxyethyl)thio)acetamide,
2-[(2-hydroxyethyl)sulfanyl]acetamide,
Acetamide, 2-[(2-hydroxyethyl)thio]-,
2-(2-hydroxyethylsulfanyl)acetamide,
AC1NAWIV,
SCHEMBL4727074,
DTXSID80403494,
ALBB-011953,
ZINC6295459,
6778AD,
MFCD04344219,
AKOS005173357,
MCULE-8225407259,
FT-0683409,
Y-1301,
I09-2924,
C4H9NO2S,
CID4458751,
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| Complexity | 76.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.181g/mol |
| Monoisotopic Mass | 135.035g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 88.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number