Home Aminos 4-amino-1,1,1-trifluoro-2-(1-methyl-1H-imidazol-2-yl)butan-2-ol

4-amino-1,1,1-trifluoro-2-(1-methyl-1H-imidazol-2-yl)butan-2-ol

CAS No.:
929971-55-1
Catalog Number:
AG019N5B
Molecular Formula:
C8H12F3N3O
Molecular Weight:
223.1956
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Product Description
Catalog Number:
AG019N5B
Chemical Name:
4-amino-1,1,1-trifluoro-2-(1-methyl-1H-imidazol-2-yl)butan-2-ol
CAS Number:
929971-55-1
Molecular Formula:
C8H12F3N3O
Molecular Weight:
223.1956
MDL Number:
MFCD09040614
IUPAC Name:
4-amino-1,1,1-trifluoro-2-(1-methylimidazol-2-yl)butan-2-ol
InChI:
InChI=1S/C8H12F3N3O/c1-14-5-4-13-6(14)7(15,2-3-12)8(9,10)11/h4-5,15H,2-3,12H2,1H3
InChI Key:
SIEKIPLBGOZGPG-UHFFFAOYSA-N
SMILES:
NCCC(C(F)(F)F)(c1nccn1C)O
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.093g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
223.199g/mol
Monoisotopic Mass:
223.093g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties