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307306-08-7 | Benzenamine, 5-fluoro-4-iodo-2-methyl-
CAS No: 307306-08-7 Catalog No: AG003136 MDL No:
Product Description
Catalog Number:
AG003136
Chemical Name:
Benzenamine, 5-fluoro-4-iodo-2-methyl-
CAS Number:
307306-08-7
Molecular Formula:
C7H7FIN
Molecular Weight:
251.0401
IUPAC Name:
5-fluoro-4-iodo-2-methylaniline
InChI:
InChI=1S/C7H7FIN/c1-4-2-6(9)5(8)3-7(4)10/h2-3H,10H2,1H3
InChI Key:
SOOKBJGPYYCNEA-UHFFFAOYSA-N
SMILES:
Nc1cc(F)c(cc1C)I
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.961g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.043g/mol
Monoisotopic Mass:
250.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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