5-Methyl-2-(1H-pyrazol-1-yl)benzaldehyde - CAS 956723-07-2
Catalog: |
BB041804 |
Product Name: |
5-Methyl-2-(1H-pyrazol-1-yl)benzaldehyde |
CAS: |
956723-07-2 |
Synonyms: |
5-methyl-2-pyrazol-1-ylbenzaldehyde |
IUPAC Name: | 5-methyl-2-pyrazol-1-ylbenzaldehyde |
Description: | 5-Methyl-2-(1H-pyrazol-1-yl)benzaldehyde (CAS# 956723-07-2) is a useful research chemical. |
Molecular Weight: | 186.21 |
Molecular Formula: | C11H10N2O |
Canonical SMILES: | CC1=CC(=C(C=C1)N2C=CC=N2)C=O |
InChI: | InChI=1S/C11H10N2O/c1-9-3-4-11(10(7-9)8-14)13-6-2-5-12-13/h2-8H,1H3 |
InChI Key: | LUDLYOVAMFPRFA-UHFFFAOYSA-N |
Boiling Point: | 325.4 °C at 760 mmHg |
Density: | 1.13 g/cm3 |
MDL: | MFCD09054722 |
LogP: | 1.99320 |
Publication Number | Title | Priority Date |
EP-2855453-A1 | Benzimidazole-proline derivatives | 20120604 |
WO-2013182972-A1 | Benzimidazole-proline derivatives | 20120604 |
EP-2376431-A1 | Novel substituted aryl derivatives, their process of preparation and their therapeutical uses as anti-hiv agents | 20081210 |
US-2012022054-A1 | Novel substituted aryl derivatives, their process of preparation and their therapeutical uses as anti-hiv agents | 20081210 |
WO-2010066847-A1 | Novel substituted aryl derivatives, their process of preparation and their therapeutical uses as anti-hiv agents | 20081210 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.079312947 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 34.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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