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866683-76-3 | 2-?Fluoro-?5-?iodo-?N-?methylbenzamide
CAS No: 866683-76-3 Catalog No: AG01EXZO MDL No:
Product Description
Catalog Number:
AG01EXZO
Chemical Name:
2-?Fluoro-?5-?iodo-?N-?methylbenzamide
CAS Number:
866683-76-3
Molecular Formula:
C8H7FINO
Molecular Weight:
279.0502
IUPAC Name:
2-fluoro-5-iodo-N-methylbenzamide
InChI:
InChI=1S/C8H7FINO/c1-11-8(12)6-4-5(10)2-3-7(6)9/h2-4H,1H3,(H,11,12)
InChI Key:
NNDGUGOBUSETHO-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cc(I)ccc1F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.956g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.053g/mol
Monoisotopic Mass:
278.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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