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24167-53-1 | 4-Iodo-N,N-dimethylbenzamide
CAS No: 24167-53-1 Catalog No: AG007O4B MDL No:MFCD02636486
Product Description
Catalog Number:
AG007O4B
Chemical Name:
4-Iodo-N,N-dimethylbenzamide
CAS Number:
24167-53-1
Molecular Formula:
C9H10INO
Molecular Weight:
275.0863
MDL Number:
MFCD02636486
IUPAC Name:
4-iodo-N,N-dimethylbenzamide
InChI:
InChI=1S/C9H10INO/c1-11(2)9(12)7-3-5-8(10)6-4-7/h3-6H,1-2H3
InChI Key:
ZPTKPSCMQWCYSN-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccc(cc1)I)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.089g/mol
Monoisotopic Mass:
274.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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