Home Halogens 1-[(4-chloro-3-fluorophenyl)methyl]-1H-pyrazol-5-amine

1-[(4-chloro-3-fluorophenyl)methyl]-1H-pyrazol-5-amine

CAS No.:
1247685-02-4
Catalog Number:
AG01AGZ2
Molecular Formula:
C10H9ClFN3
Molecular Weight:
225.6500
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Product Description
Catalog Number:
AG01AGZ2
Chemical Name:
1-[(4-chloro-3-fluorophenyl)methyl]-1H-pyrazol-5-amine
CAS Number:
1247685-02-4
Molecular Formula:
C10H9ClFN3
Molecular Weight:
225.6500
MDL Number:
MFCD16069570
IUPAC Name:
2-[(4-chloro-3-fluorophenyl)methyl]pyrazol-3-amine
InChI:
InChI=1S/C10H9ClFN3/c11-8-2-1-7(5-9(8)12)6-15-10(13)3-4-14-15/h1-5H,6,13H2
InChI Key:
DEDZKSIRADWAFU-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1F)Cn1nccc1N
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.047g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.651g/mol
Monoisotopic Mass:
225.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties