| CAS Number | 1315335-14-8 |
| Catalog Number | AG009YMB(AGN-PC-0WB6GJ) |
| Chemical Name | 2-(Dimethylamino)benzeneboronic acid, HCl |
| IUPAC Name | [2-(dimethylamino)phenyl]boronic acid;hydrochloride |
| InChI | InChI=1S/C8H12BNO2.ClH/c1-10(2)8-6-4-3-5-7(8)9(11)12;/h3-6,11-12H,1-2H3;1H |
| InChI Key | QSGXTHOTZGCZSJ-UHFFFAOYSA-N |
| MDL Number | MFCD13193902 |
| Molecular Formula | C8H13BClNO2 |
| Molecular Weight | 201.4583 |
| SMILES | C1(C=CC=CC=1N(C)C)B(O)O.Cl |
| Synonyms | 1315335-14-8,
2-(Dimethylamino)benzeneboronic acid hydrochloride,
[2-(dimethylamino)phenyl]boronic acid hydrochloride,
(2-(Dimethylamino)phenyl)boronic acid hydrochloride,
CTK6H9937,
MFCD07366476,
AKOS027384757,
AB30922,
NE13644,
2-Borono-N,N-dimethylaniline hydrochloride,
A-7145,
2-(dimethylamino)phenylboronic acid hydrochloride,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.457g/mol |
| Monoisotopic Mass | 201.073g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number