Home Nitros 1-fluoro-2-iodo-3-methyl-4-nitrobenzene

1-fluoro-2-iodo-3-methyl-4-nitrobenzene

CAS No.:
1803825-99-1
Catalog Number:
AG01ELBH
Molecular Formula:
C7H5FINO2
Molecular Weight:
281.0230
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Product Description
Catalog Number:
AG01ELBH
Chemical Name:
1-fluoro-2-iodo-3-methyl-4-nitrobenzene
CAS Number:
1803825-99-1
Molecular Formula:
C7H5FINO2
Molecular Weight:
281.0230
MDL Number:
MFCD28796485
IUPAC Name:
1-fluoro-2-iodo-3-methyl-4-nitrobenzene
InChI:
InChI=1S/C7H5FINO2/c1-4-6(10(11)12)3-2-5(8)7(4)9/h2-3H,1H3
InChI Key:
PEQVZIPDTLKJDM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1C)I)F
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.935g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.025g/mol
Monoisotopic Mass:
280.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties