Home Amines 1015845-96-1
1015845-96-1,MFCD22419414
Catalog No.:AA0004S4
1015845-96-1 | 1-(4-Fluorobenzyl)-4-methyl-1h-pyrazol-5-amine
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1g
95%
in stock  
$74.00   $52.00
- +
5g
95%
in stock  
$212.00   $148.00
- +
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Technical Information
Catalog Number:
AA0004S4
Chemical Name:
1-(4-Fluorobenzyl)-4-methyl-1h-pyrazol-5-amine
CAS Number:
1015845-96-1
Molecular Formula:
C11H12FN3
Molecular Weight:
205.2315
MDL Number:
MFCD22419414
IUPAC Name:
2-[(4-fluorophenyl)methyl]-4-methylpyrazol-3-amine
InChI:
InChI=1S/C11H12FN3/c1-8-6-14-15(11(8)13)7-9-2-4-10(12)5-3-9/h2-6H,7,13H2,1H3
InChI Key:
BYYKVAPUNIFEHX-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Cn1ncc(c1N)C
Properties
Computed Properties
 
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.102g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.236g/mol
Monoisotopic Mass:
205.102g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Synonyms
 
1-(4-FLUOROBENZYL)-4-METHYL-1H-PYRAZOL-5-AMINE 
1015845-96-1 
Y-4253 
1-[(4-Fluorophenyl)methyl]-4-methyl-1H-pyrazol-5-amine 
1H-Pyrazol-5-amine, 1-[(4-fluorophenyl)methyl]-4-methyl- 
CTK3J9952 
DTXSID40650881 
ZX-CM004302 
MFCD08691581 
ZINC19090114 
AKOS009271354 
MCULE-9807366596 
AJ-71347 
Literature
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