4-Bromo-6-methyl-1H-indazole - CAS 885521-94-8
Catalog: |
BB038995 |
Product Name: |
4-Bromo-6-methyl-1H-indazole |
CAS: |
885521-94-8 |
Synonyms: |
4-bromo-6-methyl-1H-indazole; 4-bromo-6-methyl-1H-indazole |
IUPAC Name: | 4-bromo-6-methyl-1H-indazole |
Description: | 4-Bromo-6-methyl-1H-indazole (CAS# 885521-94-8) is a useful research chemical. |
Molecular Weight: | 211.06 |
Molecular Formula: | C8H7BrN2 |
Canonical SMILES: | CC1=CC2=C(C=NN2)C(=C1)Br |
InChI: | InChI=1S/C8H7BrN2/c1-5-2-7(9)6-4-10-11-8(6)3-5/h2-4H,1H3,(H,10,11) |
InChI Key: | WVLOLHQWIPXVBQ-UHFFFAOYSA-N |
LogP: | 2.63380 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-107556244-B | Fused ring compound, pharmaceutical composition and application thereof | 20160701 |
CA-2844729-A1 | Serine/threonine pak1 inhibitors | 20110825 |
EP-2748159-A1 | Serine/threonine pak1 inhibitors | 20110825 |
JP-2014524456-A | Serine / threonine PAK1 inhibitor | 20110825 |
KR-20140062079-A | Serine / threonine PAK1 inhibitor | 20110825 |
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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