| CAS Number | 75293-95-7 |
| Catalog Number | AG00GAIY(AGN-PC-043KE5) |
| Chemical Name | 4-Bromo-5-chlorobenzene-1,2-diamine |
| IUPAC Name | 4-bromo-5-chlorobenzene-1,2-diamine |
| InChI | InChI=1S/C6H6BrClN2/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,9-10H2 |
| InChI Key | VBJCMWQIEHOUAT-UHFFFAOYSA-N |
| MDL Number | MFCD16987754 |
| Molecular Formula | C6H6BrClN2 |
| Molecular Weight | 221.4822 |
| SMILES | NC1=CC(Cl)=C(Br)C=C1N |
| Synonyms | 4-bromo-5-chlorobenzene-1,2-diamine,
75293-95-7,
SCHEMBL231150,
VBJCMWQIEHOUAT-UHFFFAOYSA-N,
MFCD16987754,
ZINC95935545,
AKOS026674142,
AS-47803,
DA-17722,
FT-0767588,
Z2065788105,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.482g/mol |
| Monoisotopic Mass | 219.94g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^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