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Home Halogens 2-Bromo-5-iodo-4-nitrobenzotrifluoride

2-Bromo-5-iodo-4-nitrobenzotrifluoride

CAS No.:
1187385-82-5
Catalog Number:
AG0080XP
Molecular Formula:
C7H2BrF3INO2
Molecular Weight:
395.9000
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG0080XP
Chemical Name:
2-Bromo-5-iodo-4-nitrobenzotrifluoride
CAS Number:
1187385-82-5
Molecular Formula:
C7H2BrF3INO2
Molecular Weight:
395.9000
MDL Number:
MFCD12913962
IUPAC Name:
1-bromo-4-iodo-5-nitro-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2BrF3INO2/c8-4-2-6(13(14)15)5(12)1-3(4)7(9,10)11/h1-2H
InChI Key:
VKMQPFOZIBWBPJ-UHFFFAOYSA-N
SMILES:
Brc1cc([N+](=O)[O-])c(cc1C(F)(F)F)I
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.827g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.902g/mol
Monoisotopic Mass:
394.827g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties