| CAS Number | 1219198-88-5 |
| Catalog Number | AG00IWYC(AGN-PC-0WB0LQ) |
| Chemical Name | methyl amino(3-bromophenyl)acetate hydrochloride |
| IUPAC Name | methyl 2-amino-2-(3-bromophenyl)acetate;hydrochloride |
| InChI | InChI=1S/C9H10BrNO2.ClH/c1-13-9(12)8(11)6-3-2-4-7(10)5-6;/h2-5,8H,11H2,1H3;1H |
| InChI Key | UYQXPUQVLSXOMR-UHFFFAOYSA-N |
| MDL Number | MFCD11841010 |
| Molecular Formula | C9H11BrClNO2 |
| Molecular Weight | 280.5461 |
| SMILES | COC(=O)C(C1=CC(=CC=C1)Br)N.Cl |
| Synonyms | Methyl amino(3-bromophenyl)acetate hydrochloride,
1219198-88-5,
methyl 2-amino-2-(3-bromophenyl)acetate hydrochloride,
(R)-Methyl 2-amino-2-(3-bromophenyl)acetate hydrochloride,
(S)-Methyl 2-amino-2-(3-bromophenyl)acetate hydrochloride,
1391518-81-2,
F2147-0609,
1391457-11-6,
CTK6I7312,
KS-000027AO,
MFCD11841010,
AKOS005073171,
KC-0743,
MCULE-2911121550,
RP15481,
TR-065138,
Methyl alpha-amino-3-bromobenzeneacetate HCl,
L-2733,
Methyl 2-amino-2-(3-bromophenyl)acetate HCl,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.966g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.546g/mol |
| Monoisotopic Mass | 278.966g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number