| CAS Number | 1384596-71-7 |
| Catalog Number | AG019ZNG(AGN-PC-0WO90J) |
| Chemical Name | 1-(4-Bromo-1-methyl-1H-pyrrol-2-yl)-N-methylmethanamine |
| IUPAC Name | 1-(4-bromo-1-methylpyrrol-2-yl)-N-methylmethanamine |
| InChI | InChI=1S/C7H11BrN2/c1-9-4-7-3-6(8)5-10(7)2/h3,5,9H,4H2,1-2H3 |
| InChI Key | AMZHJITWFQCLRZ-UHFFFAOYSA-N |
| MDL Number | MFCD22375259 |
| Molecular Formula | C7H11BrN2 |
| Molecular Weight | 203.0796 |
| SMILES | CNCC1N(C)C=C(Br)C=1 |
| Synonyms | [(4-bromo-1-methyl-1H-pyrrol-2-yl)methyl](methyl)amine,
1384596-71-7,
ZINC75110474,
AKOS024258932,
MCULE-9825544998,
NE34507,
RP26003,
AJ-121593,
Z1416200853,
1-(4-Bromo-1-methyl-1H-pyrrol-2-yl)-N-methylmethanamine,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.083g/mol |
| Monoisotopic Mass | 202.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number