| CAS Number | 1363382-02-8 |
| Catalog Number | AG0011P2(AGN-PC-0WBRC3) |
| Chemical Name | 1H-Pyrrolo[2,3-b]pyridine, 4-bromo-3-methyl- |
| IUPAC Name | 4-bromo-3-methyl-1H-pyrrolo[2,3-b]pyridine |
| InChI | InChI=1S/C8H7BrN2/c1-5-4-11-8-7(5)6(9)2-3-10-8/h2-4H,1H3,(H,10,11) |
| InChI Key | GFSUMMCGIHFVNS-UHFFFAOYSA-N |
| MDL Number | MFCD22566175 |
| Molecular Formula | C8H7BrN2 |
| Molecular Weight | 211.0586 |
| SMILES | CC1=CNC2=NC=CC(Br)=C21 |
| Synonyms | 1363382-02-8,
4-bromo-3-methyl-1H-pyrrolo[2,3-b]pyridine,
4-BROMO-3-METHYL-7-AZAINDOLE,
AK170437,
SCHEMBL19932612,
KS-000005NB,
MFCD22566175,
ZINC96372390,
AKOS025290732,
DS-7580,
FCH2289906,
PB38010,
SB13212,
CS-0043152,
Q-3706,
1H-Pyrrolo[2,3-b]pyridine, 4-bromo-3-methyl-,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.062g/mol |
| Monoisotopic Mass | 209.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number