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Common molecules sample 50916 - Reciprocal Net Log in
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Empirical formula: C21H36N2O3
a: 12.104 Å
b: 6.860 Å
c: 27.186 Å
α (alpha): 90.00 °
β (beta): 93.46 °
γ (gamma): 90.00 °
Volume: 2253.23 Å3
Space group: P21/c
Calculated density: 1.075 g/cm3
Z: 4
Temperature: 22.0 °C
Formula weight: 364.529 g/mole
R(F): 0.0930
Structural formula: C7H8O1, C14H28N2O2
CSD refcode: DUGRIG
Empirical formula - less solvent: C7H8O1
Short description: m-Cresol, a possible toxic carcinogen, has many applications in industry.
Keyword: plasticizer
Keyword: disinfectant
Common name: m-Cresol
Citation of a publication: F.Toda, Y.Tagami, T.C.W.Mak (1986) Bull.Chem.Soc.Jpn., 59,1189
Layman's explanation: M-Cresol is obtained from coal tar or petroleum as a clear to amber colored liquid or semi-solid. M-cresol has many applications such as plasticizers, gasoline additives, pigments, disinfectants, antioxidants, and pharmaceutical intermediates. This aromatic compound has a phenolic odor and is even used in perfumes. Recent studies done by the U.S. National Toxicology Program have revealed that m-cresol is actually slightly to moderately toxic and the U.S. Environmental Protection Agency has declared that m-cresol is a possible cancer causing carcinogen. m-cresol is currently not banned in the United States, however current research is focusing on its possible toxicity and cancer causing properties.
IUPAC name: N,N,N',N'-tetraisopropyloxamide
Lab name: Common molecules
Sample provider: Obtained courtesy of the Cambridge Structural Database
Status: Complete, visible to public
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Repository Files:
50916.cif 50916.crt 50916.gif 50916.pdb 50916.sdt
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