Home Aminos 2,6-Diaminotoluene

2,6-Diaminotoluene

CAS No.:
823-40-5
Catalog Number:
AG008KKJ
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$13
- +
25g
97%
In Stock USA
United States
$32
- +
100g
97%
In Stock USA
United States
$75
- +
500g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG008KKJ
Chemical Name:
2,6-Diaminotoluene
CAS Number:
823-40-5
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
MDL Number:
MFCD00007800
IUPAC Name:
2-methylbenzene-1,3-diamine
InChI:
InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3
InChI Key:
RLYCRLGLCUXUPO-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1C)N
EC Number:
212-513-9
UNII:
H838Q10551
NSC Number:
147490
RTECS Number:
XS9750000
UN Number:
3077
Properties
Complexity:
82.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
122.171g/mol
Monoisotopic Mass:
122.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Applicability of a gene expression based prediction method to SD and Wistar rats: an example of CARCINOscreen®. The Journal of toxicological sciences 20151201
Air exposure assessment of TDI and biological monitoring of TDA in urine in workers in polyurethane foam industry. Occupational and environmental medicine 20120201
Biological monitoring as a valid tool to assess occupational exposure to mixtures of 2,4-:2,6-toluene diisocyanate. La Medicina del lavoro 20120101
Concordance between Results of Medium-term Liver Carcinogenesis Bioassays and Long-term Findings for Carcinogenic 2-Nitropropane and Non-carcinogenic1-Nitropropane in F344 Rats. Journal of toxicologic pathology 20111201
Environmental isocyanate-induced asthma: morphologic and pathogenetic aspects of an increasing occupational disease. International journal of environmental research and public health 20110901
Elimination kinetics of diisocyanates after specific inhalative challenges in humans: mass spectrometry analysis, as a basis for biomonitoring strategies. Journal of occupational medicine and toxicology (London, England) 20110101
New short term prediction method for chemical carcinogenicity by hepatic transcript profiling following 28-day toxicity tests in rats. Cancer informatics 20110101
Collaborative study on fifteen compounds in the rat-liver Comet assay integrated into 2- and 4-week repeat-dose studies. Mutation research 20100930
Determination of aromatic amines in aqueous extracts of polyurethane foam using hydrophilic interaction liquid chromatography and mass spectrometry. Analytica chimica acta 20100923
Integration of in vivo genotoxicity and short-term carcinogenicity assays using F344 gpt delta transgenic rats: in vivo mutagenicity of 2,4-diaminotoluene and 2,6-diaminotoluene structural isomers. Toxicological sciences : an official journal of the Society of Toxicology 20100301
Syrian hamster embryo (SHE) cell transformation assay with conditioned media (without X-ray irradiated feeder layer) using 2,4-diaminotoluene, 2,6-diaminotoluene and chloral hydrate. Mutation research 20080731
Biological monitoring of TDI-derived amines in polyurethane foam production. Occupational medicine (Oxford, England) 20070901
Removal of dinitrotoluenes from water via reduction with iron and peroxidase-catalyzed oxidative polymerization: a comparison between Arthromyces ramosus peroxidase and soybean peroxidase. Chemosphere 20070401
Differences in gene expression profiles in the liver between carcinogenic and non-carcinogenic isomers of compounds given to rats in a 28-day repeat-dose toxicity study. Toxicology and applied pharmacology 20061215
Induction of LacZ mutations in Muta Mouse can distinguish carcinogenic from non-carcinogenic analogues of diaminotoluenes and nitronaphthalenes. Mutation research 20060919
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Ab initio MO analysis of the excited electronic states of high-spin quintet 2-methylphenylene-1,3-dinitrene. Angewandte Chemie (International ed. in English) 20060327
Risk evaluation of occupational exposure to methylene dianiline and toluene diamine in polyurethane foam. Human & experimental toxicology 20051201
Upper reference limits for biomarkers of exposure to aromatic diisocyanates. International archives of occupational and environmental health 20050801
Improvement in the GC-MS method for determining urinary toluene-diamine and its application to the biological monitoring of workers exposed to toluene-diisocyanate. International archives of occupational and environmental health 20050701
Biological monitoring of exposure to toluene diisocyanate. Scandinavian journal of work, environment & health 20041001
Hydrolytic stability of toluene diisocyanate and polymeric methylenediphenyl diisocyanate based polyureas under environmental conditions. Environmental science & technology 20040215
[Assessment of the emission of volatile organic compounds from polyurethane foams]. Roczniki Panstwowego Zakladu Higieny 20040101
Development, validation and characterization of an analytical method for the quantification of hydrolysable urinary metabolites and plasma protein adducts of 2,4- and 2,6-toluene diisocyanate, 1,5-naphthalene diisocyanate and 4,4'-methylenediphenyl diisocyanate. Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals 20030101
Biological monitoring of aromatic diisocyanates in workers exposed to thermal degradation products of polyurethanes. Journal of environmental monitoring : JEM 20021001
LC-MS determination of urinary toluenediamine in workers exposed to toluenediisocyanate. Toxicology letters 20020805
Organic analysis by ion chromatography. 1. Determination of aromatic amines and aromatic diisocyanates by cation-exchange chromatography with amperometric detection. Journal of chromatography. A 20020517
Exposure to 2,4- and 2,6-toluene diisocyanate (TDI) during production of flexible foam: determination of airborne TDI and urinary 2,4- and 2,6-toluenediamine (TDA). The Analyst 20010701
Interaction with the aromatic hydrocarbon receptor, CYP1A induction, and mutagenicity of a series of diaminotoluenes: implications for their carcinogenicity. Toxicology and applied pharmacology 19960701
Comparison of DNA binding between the carcinogen 2,6-dinitrotoluene and its noncarcinogenic analog 2,6-diaminotoluene. Mutation research 19930201
Properties