| CAS Number | 1162696-92-5 |
| Catalog Number | AG01FH7X(AGN-PC-0H8LA0) |
| Chemical Name | 4-Bromo-3-methoxybenzene-1,2-diamine |
| IUPAC Name | 4-bromo-3-methoxybenzene-1,2-diamine |
| InChI | InChI=1S/C7H9BrN2O/c1-11-7-4(8)2-3-5(9)6(7)10/h2-3H,9-10H2,1H3 |
| InChI Key | DDJZDDOQHVYOJF-UHFFFAOYSA-N |
| MDL Number | MFCD24643738 |
| Molecular Formula | C7H9BrN2O |
| Molecular Weight | 217.0632 |
| SMILES | BrC=1C(=C(C(=CC1)N)N)OC |
| Synonyms | 4-bromo-3-methoxybenzene-1,2-diamine,
1162696-92-5,
4-bromo-3-methoxy-benzene-1,2-diamine,
4-Bromo-3-methoxyphenylene-1,2-diamine,
SCHEMBL1519286,
DDJZDDOQHVYOJF-UHFFFAOYSA-N,
MFCD24643738,
AKOS027385349,
ZINC116420093,
FCH1959964,
OR400692,
PS-10968,
CS-0091218,
|
| 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