Home Amines 1015845-68-7
1015845-68-7,MFCD08457375
Catalog No.:AA0004SO
1015845-68-7 | 1-(2-Chlorobenzyl)-4-methyl-1h-pyrazol-5-amine
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Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$74.00   $52.00
- +
5g
95%
in stock  
$212.00   $148.00
- +
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Technical Information
Catalog Number:
AA0004SO
Chemical Name:
1-(2-Chlorobenzyl)-4-methyl-1h-pyrazol-5-amine
CAS Number:
1015845-68-7
Molecular Formula:
C11H12ClN3
Molecular Weight:
221.6861
MDL Number:
MFCD08457375
IUPAC Name:
2-[(2-chlorophenyl)methyl]-4-methylpyrazol-3-amine
InChI:
InChI=1S/C11H12ClN3/c1-8-6-14-15(11(8)13)7-9-4-2-3-5-10(9)12/h2-6H,7,13H2,1H3
InChI Key:
KLMAUNDTLYRLNW-UHFFFAOYSA-N
SMILES:
Clc1ccccc1Cn1ncc(c1N)C
Properties
Computed Properties
 
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.072g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.688g/mol
Monoisotopic Mass:
221.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
1015845-68-7 
1-(2-CHLOROBENZYL)-4-METHYL-1H-PYRAZOL-5-AMINE 
ZINC19091179 
AKOS002659440 
AJ-71565 
BB 0222331 
FT-0683512 
Y-3914 
2-(2-Chlorobenzyl)-4-methyl-2H-pyrazol-3-ylamine 
2-[(2-chlorophenyl)methyl]-4-methylpyrazol-3-amine 
2-(2-Chloro-benzyl)-4-methyl-2H-pyrazol-3-yl amine 
I01-14338 
1H-pyrazol-5-amine, 1-[(2-chlorophenyl)methyl]-4-methyl- 
1-[(2-Chlorophenyl)methyl]-4-methyl-1H-pyrazol-5-amine 
C11H12ClN3 
CTK3J9932 
DTXSID70650930 
ALBB-012198 
ZX-AN011004 
ZX-CM005195 
7384AC 
MFCD08457375 
Literature
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