| CAS Number | 2137851-86-4 |
| Catalog Number | AG01EL7S |
| Chemical Name | 4-chloro-3-methyl-1H-pyrrolo[2,3-b]pyridine hydrochloride |
| IUPAC Name | 4-chloro-3-methyl-1H-pyrrolo[2,3-b]pyridine;hydrochloride |
| InChI | InChI=1S/C8H7ClN2.ClH/c1-5-4-11-8-7(5)6(9)2-3-10-8;/h2-4H,1H3,(H,10,11);1H |
| InChI Key | JBAXKJGIEFSGRK-UHFFFAOYSA-N |
| MDL Number | MFCD31435876 |
| Molecular Formula | C8H8Cl2N2 |
| Molecular Weight | 203.0685 |
| SMILES | Cl.CC1C2=C(N=CC=C2Cl)NC=1 |
| Synonyms | 4-chloro-3-methyl-1H-pyrrolo[2,3-b]pyridine hydrochloride,
2137851-86-4,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.066g/mol |
| Monoisotopic Mass | 202.006g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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