Home Other Building Blocks 4-[3,5-BIS(TRIFLUOROMETHYL)PHENOXY]ANILINE

4-[3,5-BIS(TRIFLUOROMETHYL)PHENOXY]ANILINE

CAS No.:
57688-35-4
Catalog Number:
AG00EA2I
Molecular Formula:
C14H9F6NO
Molecular Weight:
321.2178
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Product Description
Catalog Number:
AG00EA2I
Chemical Name:
4-[3,5-BIS(TRIFLUOROMETHYL)PHENOXY]ANILINE
CAS Number:
57688-35-4
Molecular Formula:
C14H9F6NO
Molecular Weight:
321.2178
MDL Number:
MFCD00662561
IUPAC Name:
4-[3,5-bis(trifluoromethyl)phenoxy]aniline
InChI:
InChI=1S/C14H9F6NO/c15-13(16,17)8-5-9(14(18,19)20)7-12(6-8)22-11-3-1-10(21)2-4-11/h1-7H,21H2
InChI Key:
NVVAZFXYMGPKBC-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)Oc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.059g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
321.222g/mol
Monoisotopic Mass:
321.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties