5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine - CAS 885223-65-4
Catalog: |
BB071342 |
Product Name: |
5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine |
CAS: |
885223-65-4 |
Synonyms: |
5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine; 5-bromo-3-methyl-2H-pyrazolo[3,4-b]pyridine; 1H-PYRAZOLO[3,4-B]PYRIDINE, 5-BROMO-3-METHYL- |
IUPAC Name: | 5-bromo-3-methyl-2H-pyrazolo[3,4-b]pyridine |
Description: | 5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine |
Molecular Weight: | 212.05 |
Molecular Formula: | C7H6BrN3 |
Canonical SMILES: | CC1=C2C=C(C=NC2=NN1)Br |
InChI: | InChI=1S/C7H6BrN3/c1-4-6-2-5(8)3-9-7(6)11-10-4/h2-3H,1H3,(H,9,10,11) |
InChI Key: | NHGRQAMIQCHTFI-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.97451 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.97451 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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