1-(2-Fluorobenzyl)-4-methyl-1H-pyrazol-3-amine - CAS 1174861-73-4
Catalog: |
BB053178 |
Product Name: |
1-(2-Fluorobenzyl)-4-methyl-1H-pyrazol-3-amine |
CAS: |
1174861-73-4 |
Synonyms: |
1-[(2-fluorophenyl)methyl]-4-methylpyrazole-3-ylamine |
IUPAC Name: | 1-[(2-fluorophenyl)methyl]-4-methylpyrazol-3-amine |
Molecular Weight: | 205.23 |
Molecular Formula: | C11H12FN3 |
Canonical SMILES: | CC1=CN(N=C1N)CC2=CC=CC=C2F |
InChI: | InChI=1S/C11H12FN3/c1-8-6-15(14-11(8)13)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3,(H2,13,14) |
InChI Key: | ZWKQDKXASNDJCR-UHFFFAOYSA-N |
Boiling Point: | 374.9±37.0 °C at 760 mmHg |
Density: | 1.2±0.1 g/cm3 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.10152556 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.10152556 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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