Common molecules sample 50916

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Empirical formula:	C₂₁H₃₆N₂O₃
a:	6.885 Å
b:	17.402 Å
c:	16.637 Å
α (alpha):	90.00 °
β (beta):	96.08 °
γ (gamma):	90.00 °
Volume:	1982.11 Å³
Space group:	P21/n
Calculated density:	4.275 g/cm³
Z:	14
Temperature:	22.0 °C
Formula weight:	364.529 g/mole
R(F):	0.0580
Empirical formula - less solvent:	C₇H₈O₁
Short description:	m-Cresol, a possible toxic carcinogen, has many applications in industry.
Common name:	m-Cresol
Keyword:	carcinogen
Keyword:	disinfectant
Keyword:	fumigants
Keyword:	plasticizer
CSD refcode:	FARXOL
Structural formula:	C₂₈H₄₆N₂O₂, 2(C₇H₈O)
IUPAC name:	N,N,N',N'-tetraisopropyloxamide
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, making explosives, pigments, disinfectants, antioxidants, fumigants 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 carcinogen. m-cresol is currently not banned in the United States, however current research is focusing on its possible toxicity and cancer causing properties.
Citation of a publication:	F.Toda, Y.Tagami, T.C.W.Mak; Chem. Lett., (1986), 1909
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.ort	50916.pdb
50916.sdt