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289039-20-9 | Benzamide, 5-bromo-2-iodo-
CAS No: 289039-20-9 Catalog No: AG002X0C MDL No:MFCD00672947
Product Description
Catalog Number:
AG002X0C
Chemical Name:
Benzamide, 5-bromo-2-iodo-
CAS Number:
289039-20-9
Molecular Formula:
C7H5BrINO
Molecular Weight:
325.9292
MDL Number:
MFCD00672947
IUPAC Name:
5-bromo-2-iodobenzamide
InChI:
InChI=1S/C7H5BrINO/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H2,10,11)
InChI Key:
PSQDNPRLSXTGEU-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C(=O)N)I
EC Number:
608-275-4
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.86g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.931g/mol
Monoisotopic Mass:
324.86g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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