| CAS Number | 1211535-27-1 |
| Catalog Number | AG00HFYK |
| Chemical Name | Tert-butyl (4-(aminomethyl)thiazol-2-yl)carbamate |
| IUPAC Name | tert-butyl N-[4-(aminomethyl)-1,3-thiazol-2-yl]carbamate |
| InChI | InChI=1S/C9H15N3O2S/c1-9(2,3)14-8(13)12-7-11-6(4-10)5-15-7/h5H,4,10H2,1-3H3,(H,11,12,13) |
| InChI Key | SEKNAIFIARYMTJ-UHFFFAOYSA-N |
| MDL Number | MFCD18432794 |
| Molecular Formula | C9H15N3O2S |
| Molecular Weight | 229.2993 |
| SMILES | CC(OC(NC1SC=C(CN)N=1)=O)(C)C |
| Synonyms | tert-butyl (4-(aminomethyl)thiazol-2-yl)carbamate,
1211535-27-1,
SCHEMBL16123390,
SEKNAIFIARYMTJ-UHFFFAOYSA-N,
tert-Butyl(4-(aminomethyl)thiazol-2-yl)carbamate,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.298g/mol |
| Monoisotopic Mass | 229.088g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number