Home Halogens 3-Amino-4-bromobenzotrifluoride

3-Amino-4-bromobenzotrifluoride

CAS No.:
454-79-5
Catalog Number:
AG0037FF
Molecular Formula:
C7H5BrF3N
Molecular Weight:
240.0205
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$13
- +
25g
97%
In Stock USA
United States
$25
- +
100g
97%
In Stock USA
United States
$75
- +
500g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0037FF
Chemical Name:
3-Amino-4-bromobenzotrifluoride
CAS Number:
454-79-5
Molecular Formula:
C7H5BrF3N
Molecular Weight:
240.0205
MDL Number:
MFCD00007637
IUPAC Name:
2-bromo-5-(trifluoromethyl)aniline
InChI:
InChI=1S/C7H5BrF3N/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3H,12H2
InChI Key:
PZDVFXUBTKPFSG-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1N)C(F)(F)F
EC Number:
207-227-6
NSC Number:
88276
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.956g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.023g/mol
Monoisotopic Mass:
238.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties