1,3,5-Trimethylhexahydro-1,3,5-triazine

Base Information

• Chemical Name: 1,3,5-Trimethylhexahydro-1,3,5-triazine
• CAS No.: 108-74-7
• Molecular Formula: C6H15 N3
• Molecular Weight: 129.205
• Hs Code.: 2933699090
• European Community (EC) Number: 203-612-8
• NSC Number: 166326
• UNII: 91CT72PELC
• DSSTox Substance ID: DTXSID6051560
• Nikkaji Number: J22.134A
• Wikipedia: 1,3,5-Trimethyl-1,3,5-triazacyclohexane
• Wikidata: Q27271395
• Mol file: 108-74-7.mol

Synonyms:108-74-7;1,3,5-Trimethyl-1,3,5-triazinane;1,3,5-Trimethylhexahydro-1,3,5-triazine;1,3,5-Triazine, hexahydro-1,3,5-trimethyl-;Hexahydro-1,3,5-trimethyl-1,3,5-triazine;1,3,5-Trimethylhexahydro-s-triazine;1,3,5-trimethyl-1,3,5-triazacyclohexane;F 7771;1,3,5-Trimethylhexahydro-sym-triazine;s-Triazine, hexahydro-1,3,5-trimethyl-;HEXAHYDRO-1,3,5-TRIMETHYL-S-TRIAZINE;EINECS 203-612-8;UNII-91CT72PELC;NSC 166326;1,3,5-trimethyl-[1,3,5]triazinane;BRN 0104191;91CT72PELC;AI3-51055;DTXSID6051560;NSC-166326;EC 203-612-8;4-26-00-00003 (Beilstein Handbook Reference);CN1CN(C)CN(C)C1;s-Triazine,3,5-trimethyl-;SCHEMBL113547;DTXCID0030112;1,5-Trimethylhexahydro-s-triazine;3-AminophenylN,N-dimethylcarbamate;Hexahydro-1,5-trimethyl-s-triazine;Tox21_304038;BBL027558;MFCD00006057;NSC166326;STK802319;AKOS015850873;1,3,5-Trimethyl-1,3,5-triazinane #;1,5-Trimethylhexahydro-1,3,5-triazine;NCGC00357245-01;CAS-108-74-7;1,3,5-TRIMETHYLTRIMETHYLENETRIAMINE;LS-155435;1,3,5-trimethyl-hexahydro-1,3,5-triazine;1,5-Triazine, hexahydro-1,3,5-trimethyl-;CS-0440581;FT-0606521;T1422;n,n',n''-trimethyl-1,3,5-triazacyclohexane;D95923;F-7771;1,3,5-Trimethylhexahydro-1,3,5-triazine, 97%;Q27271395

Chemical Property of 1,3,5-Trimethylhexahydro-1,3,5-triazine

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 2.13mmHg at 25°C
• Melting Point: -27 °C
• Refractive Index: 1.461-1.463
• Boiling Point: 162-163.5 °C
• PKA: 6.50±0.20(Predicted)
• Flash Point: 49.4°C
• PSA: 9.72000
• Density: 0.925g/cm³
• LogP: -0.51840
• Storage Temp.: Flammables area
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• Water Solubility.: 350g/L at 25℃
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 129.126597491
• Heavy Atom Count: 9
• Complexity: 63.3

Purity/Quality:

98% ^*data from raw suppliers

1,3,5-Trimethylhexahydro-1,3,5-triazine >98.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,N,C
• Statements: 36/37/38-10-52/53-43-34-22
• Safety Statements: 37/39-26-16-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN1CN(CN(C1)C)C
• Uses: 1,3,5-Trimethylhexahydro-1,3,5-triazine is used in preparation of Zirconium and Hafnium Borylimides as polymerization catalysts.

Technology Process of 1,3,5-Trimethylhexahydro-1,3,5-triazine

There total 31 articles about 1,3,5-Trimethylhexahydro-1,3,5-triazine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + methylamine (74-89-5) → 1,3,5-trimethyl-1,3,5-triazacyclohexane (108-74-7)

Guidance literature:

In water; for 4h; Heating;

Reference yield: 95.0%

trimethylsilyl <(dimethylamino)methyl>methylcarbamate (91749-17-6) → 1,3,5-trimethyl-1,3,5-triazacyclohexane (108-74-7) + Hexamethyldisiloxane (107-46-0)

Guidance literature:

With water; at 50 ℃; for 0.5h; nitrogen atmosphere;

Reference yield: 92.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + methyltrimethylsilylamine (16513-17-0) → 1,3,5-trimethyl-1,3,5-triazacyclohexane (108-74-7) + Hexamethyldisiloxane (107-46-0)

Guidance literature:

at -50 - -5 ℃; for 1h;

upstream raw materials:

formaldehyd

methylamine hydrochloride

methylamine

N,N-Dimethylpropargylamin

Downstream raw materials:

1-acetoxy-2-nitro-2-azapropane

5-ethoxycarbonyl-5-(4-methylphenylsulphonyl)-1,3-dimethyl-hexahydropyrimidine

5-ethoxycarbonyl-5-(4-methylphenylsulphonyl)-1,3-diethyl-hexahydropyrimidine

3,7-dimethyl-1,5-di-(methylphenylsulphonyl)-3,7-diazabicyclo<3,3,1>nona-2,6-dione

Refernces

• 1、 Benkeser et al.. "-". . p. 5272,5273. Retrieved 1964.
• 2、 Guillemin, J. C.,Denis, J. M.. "Flash Vacuum Thermolysis of α-Aminonitriles and Subsequent HCN Removal on Solid Base, a 'One Line' Multistep Sequence to Reactive N-Methyleneamines". . p. 951 - 952. Retrieved 1985.
• 3、 Yarmukhamedov,Baibulatova,Dokichev,Khakimova,Spirikhin,Tomilov,Yunusov. "One-step synthesis of substituted 3,5-dinitropiperidines and 1,5-dinitro-3,7-diazabicyclo[3.3.1]nonanes from 1,3-dinitropropanes". . p. 414 - 420. Retrieved 2005.
• 4、 Wang, Zongheng,Johnson, Samantha I.,Wu, Guang,Ménard, Gabriel. "Multiple N-H and C-H Hydrogen Atom Abstractions through Coordination-Induced Bond Weakening at Fe-Amine Complexes". . p. 8242 - 8251. Retrieved 2021/06/25.
• 5、 -. "Method of preparing electron deficient olefins". Page/Page column 6. . Retrieved 2010/06/11.