| CAS Number | 1104608-10-7 |
| Catalog Number | AG01AA3Y(AGN-PC-0WODMB) |
| Chemical Name | N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide |
| IUPAC Name | N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide |
| InChI | InChI=1S/C9H18N2OS/c1-7(2)3-4-10-9(12)8-5-13-6-11-8/h7-8,11H,3-6H2,1-2H3,(H,10,12) |
| InChI Key | CGCHLXIMSUPUJZ-UHFFFAOYSA-N |
| MDL Number | MFCD09950484 |
| Molecular Formula | C9H18N2OS |
| Molecular Weight | 202.3170 |
| SMILES | CC(CCNC(C1NCSC1)=O)C |
| Synonyms | N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide,
1104608-10-7,
AC1Q1PFF,
AKOS000196309,
MCULE-2818371867,
NE36691,
EN300-66972,
Z927402316,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.316g/mol |
| Monoisotopic Mass | 202.114g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number