| CAS Number | 1249199-38-9 |
| Catalog Number | AG01AF8X(AGN-PC-0WO6DA) |
| Chemical Name | N-[(3-Bromophenyl)methyl]-N-methylcyclopropanamine |
| IUPAC Name | N-[(3-bromophenyl)methyl]-N-methylcyclopropanamine |
| InChI | InChI=1S/C11H14BrN/c1-13(11-5-6-11)8-9-3-2-4-10(12)7-9/h2-4,7,11H,5-6,8H2,1H3 |
| InChI Key | SRXLXOZJJYVQOL-UHFFFAOYSA-N |
| MDL Number | MFCD14648857 |
| Molecular Formula | C11H14BrN |
| Molecular Weight | 240.1396 |
| SMILES | CN(C1CC1)CC1=CC(Br)=CC=C1 |
| Synonyms | N-[(3-bromophenyl)methyl]-N-methylcyclopropanamine,
1249199-38-9,
ZINC42295937,
AKOS009622948,
NE54563,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.144g/mol |
| Monoisotopic Mass | 239.031g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number