Home Halogens 4-bromo-1-(difluoromethyl)-2-nitrobenzene

4-bromo-1-(difluoromethyl)-2-nitrobenzene

CAS No.:
1261442-15-2
Catalog Number:
AG01A5HU
Molecular Formula:
C7H4BrF2NO2
Molecular Weight:
252.0130
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Product Description
Catalog Number:
AG01A5HU
Chemical Name:
4-bromo-1-(difluoromethyl)-2-nitrobenzene
CAS Number:
1261442-15-2
Molecular Formula:
C7H4BrF2NO2
Molecular Weight:
252.0130
MDL Number:
MFCD18391144
IUPAC Name:
4-bromo-1-(difluoromethyl)-2-nitrobenzene
InChI:
InChI=1S/C7H4BrF2NO2/c8-4-1-2-5(7(9)10)6(3-4)11(12)13/h1-3,7H
InChI Key:
WQYFQJRYDDBGOK-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)[N+](=O)[O-])C(F)F
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.939g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.015g/mol
Monoisotopic Mass:
250.939g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties