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

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

CAS No.:
1019113-91-7
Catalog Number:
AG019XYK
Molecular Formula:
C11H14F3NO
Molecular Weight:
233.2302
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Product Description
Catalog Number:
AG019XYK
Chemical Name:
3-amino-2-{[2-(trifluoromethyl)phenyl]methyl}propan-1-ol
CAS Number:
1019113-91-7
Molecular Formula:
C11H14F3NO
Molecular Weight:
233.2302
MDL Number:
MFCD11126627
IUPAC Name:
2-(aminomethyl)-3-[2-(trifluoromethyl)phenyl]propan-1-ol
InChI:
InChI=1S/C11H14F3NO/c12-11(13,14)10-4-2-1-3-9(10)5-8(6-15)7-16/h1-4,8,16H,5-7,15H2
InChI Key:
LKLSRQNEJKQAJZ-UHFFFAOYSA-N
SMILES:
NCC(Cc1ccccc1C(F)(F)F)CO
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.234g/mol
Monoisotopic Mass:
233.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties