1-(2-Fluorophenyl)-1',3'-dimethyl-1H,1'H-3,4'-bipyrazole-4-carbaldehyde - CAS 1006336-67-9
Catalog: |
BB048832 |
Product Name: |
1-(2-Fluorophenyl)-1',3'-dimethyl-1H,1'H-3,4'-bipyrazole-4-carbaldehyde |
CAS: |
1006336-67-9 |
Synonyms: |
1-(2-Fluorophenyl)-1',3'-dimethyl-1H,1'H-[3,4'-bipyrazole]-4-carbaldehyde; [3,4'-Bi-1H-pyrazole]-4-carboxaldehyde, 1-(2-fluorophenyl)-1',3'-dimethyl-; 3-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(2-fluorophenyl)-1H-pyrazole-4-carbaldehyde |
IUPAC Name: | 3-(1,3-dimethylpyrazol-4-yl)-1-(2-fluorophenyl)pyrazole-4-carbaldehyde |
Description: | 1-(2-Fluorophenyl)-1',3'-dimethyl-1H,1'H-3,4'-bipyrazole-4-carbaldehyde (CAS# 1006336-67-9 ) is a useful research chemical. |
Molecular Weight: | 284.29 |
Molecular Formula: | C15H13FN4O |
Canonical SMILES: | CC1=NN(C=C1C2=NN(C=C2C=O)C3=CC=CC=C3F)C |
InChI: | InChI=1S/C15H13FN4O/c1-10-12(8-19(2)17-10)15-11(9-21)7-20(18-15)14-6-4-3-5-13(14)16/h3-9H,1-2H3 |
InChI Key: | RLYBTNWDOKNVAT-UHFFFAOYSA-N |
Boiling Point: | 461.3±45.0 °C at 760 mmHg |
Density: | 1.3±0.1 g/cm3 |
Complexity: | 383 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.10733921 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.10733921 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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