Home Other Building Blocks 1-CHLORO-5-FLUORO-4-NITRO-2-(TRIFLUOROMETHYL)BENZENE

1-CHLORO-5-FLUORO-4-NITRO-2-(TRIFLUOROMETHYL)BENZENE

CAS No.:
862874-18-8
Catalog Number:
AG01DWQO
Molecular Formula:
C7H2ClF4NO2
Molecular Weight:
243.5429
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Product Description
Catalog Number:
AG01DWQO
Chemical Name:
1-CHLORO-5-FLUORO-4-NITRO-2-(TRIFLUOROMETHYL)BENZENE
CAS Number:
862874-18-8
Molecular Formula:
C7H2ClF4NO2
Molecular Weight:
243.5429
MDL Number:
MFCD12827972
IUPAC Name:
1-chloro-5-fluoro-4-nitro-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2ClF4NO2/c8-4-2-5(9)6(13(14)15)1-3(4)7(10,11)12/h1-2H
InChI Key:
IGABOSIUTLTMLJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(c(cc1F)Cl)C(F)(F)F
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.971g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.542g/mol
Monoisotopic Mass:
242.971g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties