| CAS Number | 1199773-24-4 |
| Catalog Number | AG000PXI(AGN-PC-0WA4GU) |
| Chemical Name | Pyrrolidine, 1-(3-bromo-5-fluorophenyl)- |
| IUPAC Name | 1-(3-bromo-5-fluorophenyl)pyrrolidine |
| InChI | InChI=1S/C10H11BrFN/c11-8-5-9(12)7-10(6-8)13-3-1-2-4-13/h5-7H,1-4H2 |
| InChI Key | KYLDQIFHZFNDFI-UHFFFAOYSA-N |
| MDL Number | MFCD13195637 |
| Molecular Formula | C10H11BrFN |
| Molecular Weight | 244.1034 |
| SMILES | FC1=CC(Br)=CC(N2CCCC2)=C1 |
| Synonyms | 1199773-24-4,
1-(3-Bromo-5-fluorophenyl)pyrrolidine,
1-Bromo-3-fluoro-5-pyrrolidinobenzene,
ACMC-209a5a,
SCHEMBL12496993,
CTK4B1588,
DTXSID60681475,
ANW-17420,
MFCD13195637,
ZINC40456589,
AKOS015835382,
AM86386,
AJ-103233,
Pyrrolidine, 1-(3-bromo-5-fluorophenyl)-,
ST2403139,
TR-034412,
Z8161,
A-5372,
I01-11040,
C10H11BrFN,
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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 | 243.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.107g/mol |
| Monoisotopic Mass | 243.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number