| CAS Number | 77563-27-0 |
| Catalog Number | AG00GC8M(AGN-PC-0UBYNK) |
| Chemical Name | 2-Methoxybenzo[d]thiazol-6-amine |
| IUPAC Name | 2-methoxy-1,3-benzothiazol-6-amine |
| InChI | InChI=1S/C8H8N2OS/c1-11-8-10-6-3-2-5(9)4-7(6)12-8/h2-4H,9H2,1H3 |
| InChI Key | LMDPSNUTSFKGTO-UHFFFAOYSA-N |
| MDL Number | MFCD18298720 |
| Molecular Formula | C8H8N2OS |
| Molecular Weight | 180.2269 |
| SMILES | NC1=CC=C2N=C(OC)SC2=C1 |
| Synonyms | 2-methoxy-1,3-benzothiazol-6-amine,
77563-27-0,
6-Benzothiazolamine, 2-methoxy- (9CI),
6-Amino-2-methoxybenzothiazole,
SCHEMBL14726160,
6-Benzothiazolamine, 2-methoxy-,
2-methoxybenzo[d]thiazol-6-amine,
ZINC45237267,
6-Benzothiazolamine,2-methoxy-(9CI),
AKOS012534178,
NE25796,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.225g/mol |
| Monoisotopic Mass | 180.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 76.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number