| CAS Number | 1261365-56-3 |
| Catalog Number | AG009WXC(AGN-PC-0WAO75) |
| Chemical Name | 5-Bromo-2-iodo-1h-pyrrolo[2,3-b]pyridine |
| IUPAC Name | 5-bromo-2-iodo-1H-pyrrolo[2,3-b]pyridine |
| InChI | InChI=1S/C7H4BrIN2/c8-5-1-4-2-6(9)11-7(4)10-3-5/h1-3H,(H,10,11) |
| InChI Key | XLGARLVBAUBSRZ-UHFFFAOYSA-N |
| MDL Number | MFCD18374130 |
| Molecular Formula | C7H4BrIN2 |
| Molecular Weight | 322.9285 |
| SMILES | BrC1=CN=C2NC(I)=CC2=C1 |
| Synonyms | 5-Bromo-2-iodo-1H-pyrrolo[2,3-b]pyridine,
1261365-56-3,
AC1Q25BE,
SCHEMBL20004649,
KM5683,
MFCD18374130,
ZINC66054291,
AKOS026672582,
CJ-21231,
PS-13148,
CS-0055958,
Z9044,
5-Bromo-2-iodo-1H-pyrrolo[2,3-b]pyridine, AldrichCPR,
C7H4BrIN2,
1111638-02-8,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 321.86g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 322.931g/mol |
| Monoisotopic Mass | 321.86g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number