| CAS Number | 860465-93-6 |
| Catalog Number | AG00IDVK(AGN-PC-0WOJLF) |
| Chemical Name | 3-Bromo-6-methoxybenzene-1,2-diamine |
| IUPAC Name | 3-bromo-6-methoxybenzene-1,2-diamine |
| InChI | InChI=1S/C7H9BrN2O/c1-11-5-3-2-4(8)6(9)7(5)10/h2-3H,9-10H2,1H3 |
| InChI Key | HTNRRCCXOPNUDZ-UHFFFAOYSA-N |
| MDL Number | MFCD20484890 |
| Molecular Formula | C7H9BrN2O |
| Molecular Weight | 217.0632 |
| SMILES | COC1=C(C(=C(C=C1)Br)N)N |
| Synonyms | 3-bromo-6-methoxybenzene-1,2-diamine,
860465-93-6,
3-bromo-6-methoxy-benzene-1,2-diamine,
SCHEMBL2497019,
HTNRRCCXOPNUDZ-UHFFFAOYSA-N,
MFCD20484890,
ZINC95704937,
AS-41068,
3-bromo-6-methoxybenzene-1,2-diamine, 95% - 1G 1g,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.066g/mol |
| Monoisotopic Mass | 215.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 61.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number