Home Halogens 4-Bromo-3-nitrobenzotrifluoride

4-Bromo-3-nitrobenzotrifluoride

CAS No.:
349-03-1
Catalog Number:
AG003KYK
Molecular Formula:
C7H3BrF3NO2
Molecular Weight:
270.0034
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$238
- +
Product Description
Catalog Number:
AG003KYK
Chemical Name:
4-Bromo-3-nitrobenzotrifluoride
CAS Number:
349-03-1
Molecular Formula:
C7H3BrF3NO2
Molecular Weight:
270.0034
MDL Number:
MFCD00014685
IUPAC Name:
1-bromo-2-nitro-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H3BrF3NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H
InChI Key:
PESPBNYBZVIGRO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Br)C(F)(F)F
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.93g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.005g/mol
Monoisotopic Mass:
268.93g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties