Home Other Building Blocks 3-Fluoro-4-(trifluoromethoxy)benzylamine

3-Fluoro-4-(trifluoromethoxy)benzylamine

CAS No.:
886499-13-4
Catalog Number:
AG003JFJ
Molecular Formula:
C8H7F4NO
Molecular Weight:
209.1409
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Product Description
Catalog Number:
AG003JFJ
Chemical Name:
3-Fluoro-4-(trifluoromethoxy)benzylamine
CAS Number:
886499-13-4
Molecular Formula:
C8H7F4NO
Molecular Weight:
209.1409
MDL Number:
MFCD06660207
IUPAC Name:
[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine
InChI:
InChI=1S/C8H7F4NO/c9-6-3-5(4-13)1-2-7(6)14-8(10,11)12/h1-3H,4,13H2
InChI Key:
LKKOOHKPOMOOAI-UHFFFAOYSA-N
SMILES:
NCc1ccc(c(c1)F)OC(F)(F)F
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.144g/mol
Monoisotopic Mass:
209.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties