Home Other Building Blocks 4-methoxy-3-(2,2,2-trifluoroethoxy)aniline

4-methoxy-3-(2,2,2-trifluoroethoxy)aniline

CAS No.:
953744-38-2
Catalog Number:
AG019MGK
Molecular Formula:
C9H10F3NO2
Molecular Weight:
221.1764
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Product Description
Catalog Number:
AG019MGK
Chemical Name:
4-methoxy-3-(2,2,2-trifluoroethoxy)aniline
CAS Number:
953744-38-2
Molecular Formula:
C9H10F3NO2
Molecular Weight:
221.1764
IUPAC Name:
4-methoxy-3-(2,2,2-trifluoroethoxy)aniline
InChI:
InChI=1S/C9H10F3NO2/c1-14-7-3-2-6(13)4-8(7)15-5-9(10,11)12/h2-4H,5,13H2,1H3
InChI Key:
VBQUAQKNJDNXLR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCC(F)(F)F)N
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.066g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.179g/mol
Monoisotopic Mass:
221.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties