| CAS Number | 1016526-95-6 |
| Catalog Number | AG01A7VN |
| Chemical Name | ethyl N-(6-amino-1,3-benzothiazol-2-yl)carbamate |
| IUPAC Name | ethyl N-(6-amino-1,3-benzothiazol-2-yl)carbamate |
| InChI | InChI=1S/C10H11N3O2S/c1-2-15-10(14)13-9-12-7-4-3-6(11)5-8(7)16-9/h3-5H,2,11H2,1H3,(H,12,13,14) |
| InChI Key | BYHHBCFFWHVHDZ-UHFFFAOYSA-N |
| MDL Number | MFCD09803607 |
| Molecular Formula | C10H11N3O2S |
| Molecular Weight | 237.2782 |
| SMILES | CCOC(NC1SC2=C(C=CC(=C2)N)N=1)=O |
| Synonyms | ethyl N-(6-amino-1,3-benzothiazol-2-yl)carbamate,
1016526-95-6,
AC1Q35C9,
CTK6F9589,
ZINC19401638,
AKOS000162008,
MCULE-1182685486,
NE43812,
EN300-59934,
Z1262246175,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.277g/mol |
| Monoisotopic Mass | 237.057g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number