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613-93-4 | N-Methylbenzamide
CAS No: 613-93-4 Catalog No: AG003T75 MDL No:MFCD00011642
Product Description
Catalog Number:
AG003T75
Chemical Name:
N-Methylbenzamide
CAS Number:
613-93-4
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD00011642
IUPAC Name:
N-methylbenzamide
InChI:
InChI=1S/C8H9NO/c1-9-8(10)7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10)
InChI Key:
NCCHARWOCKOHIH-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ccccc1
EC Number:
210-362-3
UNII:
K3ED781E08
NSC Number:
42944
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
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| A functionalized enol lactone containing a protected α-amino acid. | Acta crystallographica. Section E, Structure reports online 20101201 |
| Discovery and in vitro and in vivo profiles of 4-fluoro-N-[4-[6-(isopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-N-methylbenzamide as novel class of an orally active metabotropic glutamate receptor 1 (mGluR1) antagonist. | Bioorganic & medicinal chemistry letters 20090915 |
| Study of the Beckmann rearrangement of acetophenone oxime over porous solids by means of solid state NMR spectroscopy. | Physical chemistry chemical physics : PCCP 20090707 |
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| Field evaluation of deet, Repel Care, and three plant based essential oil repellents against mosquitoes, black flies (Diptera: Simuliidae) and land leeches (Arhynchobdellida: Haemadipsidae) in Thailand. | Journal of the American Mosquito Control Association 20060601 |
| Reactions of (benzamidomethyl)triethylammonium chloride with some inorganic nucleophiles in aqueous media. | Molecules (Basel, Switzerland) 20060410 |
| Predictive relationships for the effects of triglyceride ester concentration and water uptake on solubility and partitioning of small molecules into lipid vehicles. | Journal of pharmaceutical sciences 20041101 |
| Nucleophilic addition to 3-substituted pyridinium salts: expedient syntheses of (-)-L-733,061 and (-)-CP-99,994. | Organic letters 20040930 |
| Design and synthesis of substituted N-methylbenzamide analogues derived from SR 48,968 as neurokinin-2 receptor antagonists. | Bioorganic & medicinal chemistry letters 20040920 |
| 5'-substituted-6-carboxylic-2,2'-bipyridine acid: a pivotal architecton for building preorganized ligands. | The Journal of organic chemistry 20020531 |
| Thermodynamic analysis of the binding of aromatic hydroxamic acid analogues to ferric horseradish peroxidase. | Biochemistry 20011120 |
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