| CAS Number | 1123173-10-3 |
| Catalog Number | AG01FSD8(AGN-PC-0WNGNY) |
| Chemical Name | 2-Bromo-4-(tert-butyl)-6-fluoroaniline |
| IUPAC Name | 2-bromo-4-tert-butyl-6-fluoroaniline |
| InChI | InChI=1S/C10H13BrFN/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5H,13H2,1-3H3 |
| InChI Key | LPDHADZUFOGQQC-UHFFFAOYSA-N |
| MDL Number | MFCD28559193 |
| Molecular Formula | C10H13BrFN |
| Molecular Weight | 246.1193 |
| SMILES | CC(C)(C)C1=CC(F)=C(N)C(Br)=C1 |
| Synonyms | 2-bromo-4-(tert-butyl)-6-fluoroaniline,
1123173-10-3,
SCHEMBL3652875,
LPDHADZUFOGQQC-UHFFFAOYSA-N,
KS-00000U9L,
2-bromo-4-tert-butyl-6-fluoroaniline,
ZINC143655997,
AK684409,
DS-20099,
2-Bromo-4-tert-butyl-6-fluoro-phenylamine,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.02154g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.12g/mol |
| Monoisotopic Mass | 245.02154g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number