Home Amines 1015845-94-9
1015845-94-9,MFCD08691578
Catalog No.:AA0004S6
1015845-94-9 | 1-(3-Fluorobenzyl)-1H-pyrazol-5-amine
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1g
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$156.00   $109.00
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Technical Information
Catalog Number:
AA0004S6
Chemical Name:
1-(3-Fluorobenzyl)-1H-pyrazol-5-amine
CAS Number:
1015845-94-9
Molecular Formula:
C10H10FN3
Molecular Weight:
191.2049
MDL Number:
MFCD08691578
IUPAC Name:
2-[(3-fluorophenyl)methyl]pyrazol-3-amine
InChI:
InChI=1S/C10H10FN3/c11-9-3-1-2-8(6-9)7-14-10(12)4-5-13-14/h1-6H,7,12H2
InChI Key:
VDDFCXBMNZEGCT-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)Cn1nccc1N
Properties
Computed Properties
 
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.086g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.209g/mol
Monoisotopic Mass:
191.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
1-(3-Fluorobenzyl)-1H-pyrazol-5-amine 
1015845-94-9 
KS-6859 
AJ-71337 
Y-4250 
1H-Pyrazol-5-amine, 1-[(3-fluorophenyl)methyl]- 
2-(3-fluoro-benzyl)-2h-pyrazol-3-ylamine 
1-[(3-Fluorophenyl)methyl]-1H-pyrazol-5-amine 
SCHEMBL1460580 
CTK3J9950 
DTXSID80588391 
MFCD08691578 
ZINC19090082 
AKOS000136622 
Literature
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