Home Other Building Blocks 1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-amine dihydrochloride

1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-amine dihydrochloride

CAS No.:
1311313-82-2
Catalog Number:
AG01AHXD
Molecular Formula:
C12H15Cl2FN2S
Molecular Weight:
309.2303
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Product Description
Catalog Number:
AG01AHXD
Chemical Name:
1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-amine dihydrochloride
CAS Number:
1311313-82-2
Molecular Formula:
C12H15Cl2FN2S
Molecular Weight:
309.2303
MDL Number:
MFCD18785621
IUPAC Name:
1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethanamine;dihydrochloride
InChI:
InChI=1S/C12H13FN2S.2ClH/c1-7(14)11-8(2)15-12(16-11)9-5-3-4-6-10(9)13;;/h3-7H,14H2,1-2H3;2*1H
InChI Key:
KOPKBJZROWLAFF-UHFFFAOYSA-N
SMILES:
Fc1ccccc1c1nc(c(s1)C(N)C)C.Cl.Cl
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.032g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
309.224g/mol
Monoisotopic Mass:
308.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties