Home Other Building Blocks 5-AMINO-2-(PHENOXY)BENZOTRIFLUORIDE

5-AMINO-2-(PHENOXY)BENZOTRIFLUORIDE

CAS No.:
267416-81-9
Catalog Number:
AG00BFKY
Molecular Formula:
C13H10F3NO
Molecular Weight:
253.2198
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Product Description
Catalog Number:
AG00BFKY
Chemical Name:
5-AMINO-2-(PHENOXY)BENZOTRIFLUORIDE
CAS Number:
267416-81-9
Molecular Formula:
C13H10F3NO
Molecular Weight:
253.2198
MDL Number:
MFCD04972663
IUPAC Name:
4-phenoxy-3-(trifluoromethyl)aniline
InChI:
InChI=1S/C13H10F3NO/c14-13(15,16)11-8-9(17)6-7-12(11)18-10-4-2-1-3-5-10/h1-8H,17H2
InChI Key:
GLVOXGPMYXJKGS-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(F)(F)F)Oc1ccccc1
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.071g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.224g/mol
Monoisotopic Mass:
253.071g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties