| CAS Number | 824932-42-5 |
| Catalog Number | AG00ID8T(AGN-PC-0WQXWS) |
| Chemical Name | 2-amino-6-bromobenzenethiol |
| IUPAC Name | 2-amino-6-bromobenzenethiol |
| InChI | InChI=1S/C6H6BrNS/c7-4-2-1-3-5(8)6(4)9/h1-3,9H,8H2 |
| InChI Key | GDKDKXYKTCNBIA-UHFFFAOYSA-N |
| MDL Number | MFCD22481435 |
| Molecular Formula | C6H6BrNS |
| Molecular Weight | 204.0875 |
| SMILES | C1=CC(=C(C(=C1)Br)S)N |
| Synonyms | 2-amino-6-bromobenzenethiol,
824932-42-5,
SCHEMBL3885308,
MFCD22481435,
ZINC147780600,
AS-43514,
SC-65731,
Benzenethiol, 2-amino-6-bromo,
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| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.085g/mol |
| Monoisotopic Mass | 202.94g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 27A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number