Home Halogens 1,3-Bis[5-bromo-2-(trifluoromethyl)phenyl]triaz-1-ene

1,3-Bis[5-bromo-2-(trifluoromethyl)phenyl]triaz-1-ene

CAS No.:
1423040-58-7
Catalog Number:
AG009WVO
Molecular Formula:
C14H7Br2F6N3
Molecular Weight:
491.0239
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Product Description
Catalog Number:
AG009WVO
Chemical Name:
1,3-Bis[5-bromo-2-(trifluoromethyl)phenyl]triaz-1-ene
CAS Number:
1423040-58-7
Molecular Formula:
C14H7Br2F6N3
Molecular Weight:
491.0239
MDL Number:
MFCD23135936
IUPAC Name:
5-bromo-N-[[5-bromo-2-(trifluoromethyl)phenyl]diazenyl]-2-(trifluoromethyl)aniline
InChI:
InChI=1S/C14H7Br2F6N3/c15-7-1-3-9(13(17,18)19)11(5-7)23-25-24-12-6-8(16)2-4-10(12)14(20,21)22/h1-6H,(H,23,24)
InChI Key:
IJOKHPKHCBTIDN-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)N/N=N/c1cc(Br)ccc1C(F)(F)F)C(F)(F)F
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
490.889g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
491.029g/mol
Monoisotopic Mass:
488.891g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  
Properties