| CAS Number | 1392210-94-4 |
| Catalog Number | AG00L9Y4(AGN-PC-3H4561) |
| Chemical Name | 3-Bromoimidazo[1,2-a]pyridine-7-carbonitrile |
| IUPAC Name | 3-bromoimidazo[1,2-a]pyridine-7-carbonitrile |
| InChI | InChI=1S/C8H4BrN3/c9-7-5-11-8-3-6(4-10)1-2-12(7)8/h1-3,5H |
| InChI Key | NPVHUJAEFUUHBZ-UHFFFAOYSA-N |
| MDL Number | MFCD22372504 |
| Molecular Formula | C8H4BrN3 |
| Molecular Weight | 222.0415 |
| SMILES | N#CC2=CC1=NC=C(Br)N1C=C2 |
| Synonyms | 3-BROMOIMIDAZO[1,2-A]PYRIDINE-7-CARBONITRILE,
1392210-94-4,
Imidazo[1,2-a]pyridine-7-carbonitrile, 3-bromo-,
AKOS023786266,
ZINC212063414,
FCH1615214,
TZ001210,
885950-21-0,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.045g/mol |
| Monoisotopic Mass | 220.959g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H301-H311-H331
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number