| CAS Number | 887268-19-1 |
| Catalog Number | AG00GRXS(AGN-PC-0WD2RC) |
| Chemical Name | 2-Bromo-N,N-dimethyl-4-fluoroaniline |
| IUPAC Name | 2-bromo-4-fluoro-N,N-dimethylaniline |
| InChI | InChI=1S/C8H9BrFN/c1-11(2)8-4-3-6(10)5-7(8)9/h3-5H,1-2H3 |
| InChI Key | VLXWMTFSGVQASW-UHFFFAOYSA-N |
| MDL Number | MFCD04116317 |
| Molecular Formula | C8H9BrFN |
| Molecular Weight | 218.0662 |
| SMILES | CN(C1=C(Br)C=C(F)C=C1)C |
| Synonyms | 2-bromo-4-fluoro-N,N-dimethylaniline,
2-Bromo-N,N-dimethyl-4-fluoroaniline,
887268-19-1,
PubChem5227,
CTK7B8503,
DTXSID40654203,
ZINC2528582,
MFCD04116317,
SBB095514,
(2-bromo-4-fluorophenyl)dimethylamine,
AKOS017552713,
QC-7928,
AJ-38298,
BC002904,
PS-11725,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.069g/mol |
| Monoisotopic Mass | 216.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number