| CAS Number | 1160474-86-1 |
| Catalog Number | AG0090ZG(AGN-PC-0WAZCE) |
| Chemical Name | Ethyl 3-bromo-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate |
| IUPAC Name | ethyl 3-bromo-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate |
| InChI | InChI=1S/C11H8BrF3N2O2/c1-2-19-10(18)8-9(12)17-5-6(11(13,14)15)3-4-7(17)16-8/h3-5H,2H2,1H3 |
| InChI Key | HWFCCBLILMNNML-UHFFFAOYSA-N |
| MDL Number | MFCD12025928 |
| Molecular Formula | C11H8BrF3N2O2 |
| Molecular Weight | 337.0926 |
| SMILES | O=C(C2=C(Br)N1C=C(C(F)(F)F)C=CC1=N2)OCC |
| Synonyms | Ethyl 3-bromo-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate,
1160474-86-1,
Ethyl 3-bromo-6-(trifluoromethyl)imidazo-[1,2-a]pyridine-2-carboxylate,
CTK6F7544,
ZX-AP001734,
9711AC,
MFCD12025928,
PC6154,
ZINC36533765,
AKOS005072362,
ED-0729,
MCULE-7793892925,
RP16734,
AJ-93268,
TR-064668,
K-1142,
AS-813/43501979,
C11H8BrF3N2O2,
HWFCCBLILMNNML-UHFFFAOYSA-N,
|
| Complexity | 353 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 335.972g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 337.096g/mol |
| Monoisotopic Mass | 335.972g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number