| CAS Number | 1198096-48-8 |
| Catalog Number | AG0094LM(AGN-PC-0WAO2K) |
| Chemical Name | 5-Bromo-7-chloro-1H-pyrrolo[2,3-c]pyridine |
| IUPAC Name | 5-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridine |
| InChI | InChI=1S/C7H4BrClN2/c8-5-3-4-1-2-10-6(4)7(9)11-5/h1-3,10H |
| InChI Key | LHURNXZTMAOLSE-UHFFFAOYSA-N |
| MDL Number | MFCD13176642 |
| Molecular Formula | C7H4BrClN2 |
| Molecular Weight | 231.4771 |
| SMILES | BrC=1C=C2C(=C(N1)Cl)NC=C2 |
| Synonyms | 5-Bromo-7-chloro-1H-pyrrolo[2,3-c]pyridine,
1198096-48-8,
AC1Q3HYD,
SCHEMBL16046585,
CTK5I6517,
DTXSID70674070,
LHURNXZTMAOLSE-UHFFFAOYSA-N,
0767AD,
MFCD13176642,
ZINC39961355,
AKOS015834481,
AS-39131,
AJ-101539,
TR-070676,
A-6153,
5-Bromo-7-chloro-1H-pyrrolo[2,3-c]pyridine, AldrichCPR,
C7H4BrClN2,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.477g/mol |
| Monoisotopic Mass | 229.925g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number