| CAS Number | 1195190-04-5 |
| Catalog Number | AG01BEVM |
| Chemical Name | 4-Amino-2-bromo-5-methylphenol |
| IUPAC Name | 4-amino-2-bromo-5-methylphenol |
| InChI | InChI=1S/C7H8BrNO/c1-4-2-7(10)5(8)3-6(4)9/h2-3,10H,9H2,1H3 |
| InChI Key | SUNUYNWRSKSEDB-UHFFFAOYSA-N |
| MDL Number | MFCD24623901 |
| Molecular Formula | C7H8BrNO |
| Molecular Weight | 202.0485 |
| SMILES | CC1=C(N)C=C(Br)C(O)=C1 |
| Synonyms | 4-amino-2-bromo-5-methylphenol,
1195190-04-5,
STL433990,
ZINC78549645,
AKOS024074201,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.051g/mol |
| Monoisotopic Mass | 200.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number