Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
|
A726878-100mg
|
100mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$75.90
|
|
|
A726878-250mg
|
250mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$126.90
|
|
|
A726878-1g
|
1g |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$378.90
|
|
| Specifications & Purity | ≥95% |
|---|
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Phenols |
| Subclass | Cresols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Ortho cresols |
| Alternative Parents | o-Aminophenols P-bromophenols Aniline and substituted anilines Aminotoluenes Bromobenzenes Aryl bromides Primary amines Organooxygen compounds Organobromides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aminophenol - O-aminophenol - Aminotoluene - Aniline or substituted anilines - 4-halophenol - 4-bromophenol - O-cresol - Bromobenzene - Halobenzene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Organohalogen compound - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as ortho cresols. These are organic compounds containing an ortho-cresol moiety, which consists of a benzene bearing one hydroxyl group at ring positions 1 and 2, respectively. |
| External Descriptors | Not available |
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| ALogP | 1.1 |
|---|
| IUPAC Name | 2-amino-4-bromo-6-methylphenol |
|---|---|
| INCHI | InChI=1S/C7H8BrNO/c1-4-2-5(8)3-6(9)7(4)10/h2-3,10H,9H2,1H3 |
| InChIKey | GDFDRJARZUTLES-UHFFFAOYSA-N |
| Smiles | CC1=CC(=CC(=C1O)N)Br |
| Isomeric SMILES | CC1=CC(=CC(=C1O)N)Br |
| PubChem CID | 12514800 |
| Molecular Weight | 202.05 |
| Molecular Weight | 202.050 g/mol |
|---|---|
| XLogP3 | 1.100 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 200.979 Da |
| Monoisotopic Mass | 200.979 Da |
| Topological Polar Surface Area | 46.300 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 120.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |