Home Other Building Blocks HE-CHEMICAL 0331264

HE-CHEMICAL 0331264

CAS No.:
1805510-05-7
Catalog Number:
AG01DYZA
Molecular Formula:
C8H4BrF6N
Molecular Weight:
308.0185
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DYZA
Chemical Name:
HE-CHEMICAL 0331264
CAS Number:
1805510-05-7
Molecular Formula:
C8H4BrF6N
Molecular Weight:
308.0185
MDL Number:
MFCD28727798
IUPAC Name:
4-bromo-2,6-bis(trifluoromethyl)aniline
InChI:
InChI=1S/C8H4BrF6N/c9-3-1-4(7(10,11)12)6(16)5(2-3)8(13,14)15/h1-2H,16H2
InChI Key:
DDESBCKMFLXTKC-UHFFFAOYSA-N
SMILES:
Brc1cc(c(c(c1)C(F)(F)F)N)C(F)(F)F
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.943g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.021g/mol
Monoisotopic Mass:
306.943g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties