| CAS Number | 1057720-25-8 |
| Catalog Number | AG01BGOG |
| Chemical Name | tert-butyl N-(2-bromo-6-fluorophenyl)carbamate |
| IUPAC Name | tert-butyl N-(2-bromo-6-fluorophenyl)carbamate |
| InChI | InChI=1S/C11H13BrFNO2/c1-11(2,3)16-10(15)14-9-7(12)5-4-6-8(9)13/h4-6H,1-3H3,(H,14,15) |
| InChI Key | WWWUUAZACLRSJM-UHFFFAOYSA-N |
| MDL Number | MFCD24470774 |
| Molecular Formula | C11H13BrFNO2 |
| Molecular Weight | 290.1288 |
| SMILES | CC(OC(NC1=C(Br)C=CC=C1F)=O)(C)C |
| Synonyms | tert-butyl N-(2-bromo-6-fluorophenyl)carbamate,
1057720-25-8,
(2-bromo-6-fluoro-phenyl)-carbamic acid tert-butyl ester,
ZINC98210189,
AKOS033662380,
Z1913662828,
|
| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.132g/mol |
| Monoisotopic Mass | 289.011g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
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