| CAS Number | 1258639-55-2 |
| Catalog Number | AG01AAMJ |
| Chemical Name | (3-bromo-4-methoxyphenyl)(phenyl)methanamine hydrochloride |
| IUPAC Name | (3-bromo-4-methoxyphenyl)-phenylmethanamine;hydrochloride |
| InChI | InChI=1S/C14H14BrNO.ClH/c1-17-13-8-7-11(9-12(13)15)14(16)10-5-3-2-4-6-10;/h2-9,14H,16H2,1H3;1H |
| InChI Key | NZIQRLRDJIKGOR-UHFFFAOYSA-N |
| MDL Number | MFCD17167237 |
| Molecular Formula | C14H15BrClNO |
| Molecular Weight | 328.6320 |
| SMILES | Cl.COC1=C(Br)C=C(C(C2=CC=CC=C2)N)C=C1 |
| Synonyms | (3-bromo-4-methoxyphenyl)(phenyl)methanamine hydrochloride,
1258639-55-2,
AC1Q3BYL,
MCULE-2055403351,
NE22011,
EN300-69015,
Z1263714156,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 327.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 328.634g/mol |
| Monoisotopic Mass | 327.003g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number