Home Halogens 2-amino-2-[4-bromo-2-(trifluoromethyl)phenyl]ethan-1-ol

2-amino-2-[4-bromo-2-(trifluoromethyl)phenyl]ethan-1-ol

CAS No.:
1391317-56-8
Catalog Number:
AG01BH9G
Molecular Formula:
C9H9BrF3NO
Molecular Weight:
284.0731
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Product Description
Catalog Number:
AG01BH9G
Chemical Name:
2-amino-2-[4-bromo-2-(trifluoromethyl)phenyl]ethan-1-ol
CAS Number:
1391317-56-8
Molecular Formula:
C9H9BrF3NO
Molecular Weight:
284.0731
MDL Number:
MFCD22528882
IUPAC Name:
2-amino-2-[4-bromo-2-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H9BrF3NO/c10-5-1-2-6(8(14)4-15)7(3-5)9(11,12)13/h1-3,8,15H,4,14H2
InChI Key:
YKSJIIVDGSXRGG-UHFFFAOYSA-N
SMILES:
OCC(c1ccc(cc1C(F)(F)F)Br)N
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.982g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.076g/mol
Monoisotopic Mass:
282.982g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties