Home Other Building Blocks 1-[3-fluoro-4-(4-methyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine hydrochloride

1-[3-fluoro-4-(4-methyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine hydrochloride

CAS No.:
1354950-16-5
Catalog Number:
AG019S7Y
Molecular Formula:
C12H15ClFN3
Molecular Weight:
255.7190
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Product Description
Catalog Number:
AG019S7Y
Chemical Name:
1-[3-fluoro-4-(4-methyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine hydrochloride
CAS Number:
1354950-16-5
Molecular Formula:
C12H15ClFN3
Molecular Weight:
255.7190
MDL Number:
MFCD20501994
IUPAC Name:
1-[3-fluoro-4-(4-methylpyrazol-1-yl)phenyl]ethanamine;hydrochloride
InChI:
InChI=1S/C12H14FN3.ClH/c1-8-6-15-16(7-8)12-4-3-10(9(2)14)5-11(12)13;/h3-7,9H,14H2,1-2H3;1H
InChI Key:
IDHUTJTWZUVCPA-UHFFFAOYSA-N
SMILES:
Cc1cnn(c1)c1ccc(cc1F)C(N)C.Cl
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.094g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.721g/mol
Monoisotopic Mass:
255.094g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties