| CAS Number | 1352630-63-7 |
| Catalog Number | AG007LH7(AGN-PC-0J2C3C) |
| Chemical Name | 1-(2-Bromo-4-chlorophenyl)pyrrolidine |
| IUPAC Name | 1-(2-bromo-4-chlorophenyl)pyrrolidine |
| InChI | InChI=1S/C10H11BrClN/c11-9-7-8(12)3-4-10(9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2 |
| InChI Key | LBQLMUKOIACDRG-UHFFFAOYSA-N |
| MDL Number | MFCD21332951 |
| Molecular Formula | C10H11BrClN |
| Molecular Weight | 260.5580 |
| SMILES | Clc1ccc(c(c1)Br)N1CCCC1 |
| Synonyms | 1-(2-Bromo-4-chlorophenyl)pyrrolidine,
1352630-63-7,
ACMC-209c00,
CTK8B0339,
DTXSID30742724,
ANW-19822,
MFCD21332951,
ZINC85476822,
AKOS018444805,
CJ-22367,
TC-108567,
Z9905,
C10H11BrClN,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.559g/mol |
| Monoisotopic Mass | 258.976g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number