Home Aminos 1-(2-amino-4-methyl-1,3-thiazol-5-yl)-2,2,2-trifluoroethan-1-one

1-(2-amino-4-methyl-1,3-thiazol-5-yl)-2,2,2-trifluoroethan-1-one

CAS No.:
1695546-50-9
Catalog Number:
AG01DYTT
Molecular Formula:
C6H5F3N2OS
Molecular Weight:
210.1769
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Product Description
Catalog Number:
AG01DYTT
Chemical Name:
1-(2-amino-4-methyl-1,3-thiazol-5-yl)-2,2,2-trifluoroethan-1-one
CAS Number:
1695546-50-9
Molecular Formula:
C6H5F3N2OS
Molecular Weight:
210.1769
MDL Number:
MFCD30736637
IUPAC Name:
1-(2-amino-4-methyl-1,3-thiazol-5-yl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C6H5F3N2OS/c1-2-3(13-5(10)11-2)4(12)6(7,8)9/h1H3,(H2,10,11)
InChI Key:
BAAXCOUYFDTBRJ-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1sc(nc1C)N
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.007g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.174g/mol
Monoisotopic Mass:
210.007g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties