1-p-Tolyl-1H-pyrazole-4-carbaldehyde - CAS 337957-59-2
Catalog: |
BB021841 |
Product Name: |
1-p-Tolyl-1H-pyrazole-4-carbaldehyde |
CAS: |
337957-59-2 |
Synonyms: |
1-(4-methylphenyl)pyrazole-4-carbaldehyde |
IUPAC Name: | 1-(4-methylphenyl)pyrazole-4-carbaldehyde |
Description: | 1-p-Tolyl-1H-pyrazole-4-carbaldehyde (CAS# 337957-59-2) is a useful research chemical. |
Molecular Weight: | 186.21 |
Molecular Formula: | C11H10N2O |
Canonical SMILES: | CC1=CC=C(C=C1)N2C=C(C=N2)C=O |
InChI: | InChI=1S/C11H10N2O/c1-9-2-4-11(5-3-9)13-7-10(8-14)6-12-13/h2-8H,1H3 |
InChI Key: | LFWZUGUMUQRWIU-UHFFFAOYSA-N |
Boiling Point: | 322.9 °C at 760 mmHg |
Density: | 1.13 g/cm3 |
LogP: | 1.99320 |
Publication Number | Title | Priority Date |
TW-202012390-A | Novel substituted pyrazole derivatives | 20180629 |
WO-2019235879-A1 | Composition for preventing or treating cancer, containing novel mtor inhibitor | 20180608 |
KR-20190124666-A | Novel compounds as mTOR inhibitor and uses thereof | 20180426 |
WO-2019209083-A1 | Novel compound as mtor inhibitor and use thereof | 20180426 |
CN-112368279-A | Novel compounds as mTOR inhibitors and uses thereof | 20180426 |
Complexity: | 200 |
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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