Home Other Building Blocks 1-[3-(4-fluorophenoxy)propyl]-5-methyl-1H-pyrazol-3-amine

1-[3-(4-fluorophenoxy)propyl]-5-methyl-1H-pyrazol-3-amine

CAS No.:
1240564-84-4
Catalog Number:
AG01A2LO
Molecular Formula:
C13H16FN3O
Molecular Weight:
249.2840
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Product Description
Catalog Number:
AG01A2LO
Chemical Name:
1-[3-(4-fluorophenoxy)propyl]-5-methyl-1H-pyrazol-3-amine
CAS Number:
1240564-84-4
Molecular Formula:
C13H16FN3O
Molecular Weight:
249.2840
MDL Number:
MFCD16810983
IUPAC Name:
1-[3-(4-fluorophenoxy)propyl]-5-methylpyrazol-3-amine
InChI:
InChI=1S/C13H16FN3O/c1-10-9-13(15)16-17(10)7-2-8-18-12-5-3-11(14)4-6-12/h3-6,9H,2,7-8H2,1H3,(H2,15,16)
InChI Key:
SMFYONAEJHSGNO-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)OCCCn1nc(cc1C)N
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.128g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.289g/mol
Monoisotopic Mass:
249.128g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties