Home Aminos 3-amino-2-{[4-(trifluoromethoxy)phenyl]methyl}propan-1-ol

3-amino-2-{[4-(trifluoromethoxy)phenyl]methyl}propan-1-ol

CAS No.:
1019119-11-9
Catalog Number:
AG01A13Y
Molecular Formula:
C11H14F3NO2
Molecular Weight:
249.2296
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Product Description
Catalog Number:
AG01A13Y
Chemical Name:
3-amino-2-{[4-(trifluoromethoxy)phenyl]methyl}propan-1-ol
CAS Number:
1019119-11-9
Molecular Formula:
C11H14F3NO2
Molecular Weight:
249.2296
MDL Number:
MFCD11126223
IUPAC Name:
2-(aminomethyl)-3-[4-(trifluoromethoxy)phenyl]propan-1-ol
InChI:
InChI=1S/C11H14F3NO2/c12-11(13,14)17-10-3-1-8(2-4-10)5-9(6-15)7-16/h1-4,9,16H,5-7,15H2
InChI Key:
MKTUOSLPEQAJKR-UHFFFAOYSA-N
SMILES:
NCC(Cc1ccc(cc1)OC(F)(F)F)CO
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.233g/mol
Monoisotopic Mass:
249.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties