4-Bromo-5-methyl-1H-indazole - CAS 926922-40-9
Catalog: |
BB040598 |
Product Name: |
4-Bromo-5-methyl-1H-indazole |
CAS: |
926922-40-9 |
Synonyms: |
4-bromo-5-methyl-1H-indazole; 4-bromo-5-methyl-1H-indazole |
IUPAC Name: | 4-bromo-5-methyl-1H-indazole |
Description: | 4-Bromo-5-methyl-1H-indazole (CAS# 926922-40-9) is a useful research chemical. |
Molecular Weight: | 211.06 |
Molecular Formula: | C8H7BrN2 |
Canonical SMILES: | CC1=C(C2=C(C=C1)NN=C2)Br |
InChI: | InChI=1S/C8H7BrN2/c1-5-2-3-7-6(8(5)9)4-10-11-7/h2-4H,1H3,(H,10,11) |
InChI Key: | YBLXBXPJJAZHDS-UHFFFAOYSA-N |
Boiling Point: | 344.623 °C at 760 mmHg |
Density: | 1.655 g/cm3 |
MDL: | MFCD11044156 |
LogP: | 2.63380 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112321510-A | Preparation method of 4-bromo-5-methyl-1H-indazole | 20201027 |
WO-2021169990-A1 | Kras inhibitors for treating cancers | 20200224 |
WO-2021120890-A1 | Pyrazolyl derivatives useful as anti-cancer agents | 20191220 |
WO-2021124222-A1 | Pyrazolyl derivatives useful as anti-cancer agents | 20191220 |
CN-113004269-A | Heterocyclic compounds as Kras-G12C inhibitors | 20191219 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.97926 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.97926 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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