4-Fluoro-1-methyl-1H-indazol-3-ylamine - CAS 162502-44-5
Catalog: |
BB011877 |
Product Name: |
4-Fluoro-1-methyl-1H-indazol-3-ylamine |
CAS: |
162502-44-5 |
Synonyms: |
4-fluoro-1-methylindazol-3-amine |
IUPAC Name: | 4-fluoro-1-methylindazol-3-amine |
Description: | 4-Fluoro-1-methyl-1H-indazol-3-ylamine (CAS# 162502-44-5) is a useful research chemical. |
Molecular Weight: | 165.17 |
Molecular Formula: | C8H8FN3 |
Canonical SMILES: | CN1C2=C(C(=CC=C2)F)C(=N1)N |
InChI: | InChI=1S/C8H8FN3/c1-12-6-4-2-3-5(9)7(6)8(10)11-12/h2-4H,1H3,(H2,10,11) |
InChI Key: | QKOXHOSIONDOLA-UHFFFAOYSA-N |
Boiling Point: | 325.2 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.39 g/cm3 |
Appearance: | Solid |
LogP: | 1.87580 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113121528-A | Multi-target inhibition compound, composition, functional molecule and application thereof | 20200115 |
WO-2021143729-A1 | Compound, composition and functional molecule with multi-target inhibiting effect and use thereof | 20200115 |
AU-2015222887-A1 | 9H-pyrimido[4,5-b]indoles and related analogs as BET bromodomain inhibitors | 20140228 |
AU-2015222887-B2 | 9H-pyrimido[4,5-b]indoles and related analogs as BET bromodomain inhibitors | 20140228 |
CA-2940554-A1 | 9h-pyrimido[4,5-b]indoles and related analogs as bet bromodomain inhibitors | 20140228 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.07022543 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.07022543 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 43.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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