2-(Aminomethyl)-2-methyl-1,3-propanediamine

Base Information

• Chemical Name: 2-(Aminomethyl)-2-methyl-1,3-propanediamine
• CAS No.: 15995-42-3
• Molecular Formula: C5H15 N3
• Molecular Weight: 117.194
• Hs Code.: 2921290000
• European Community (EC) Number: 621-004-4
• DSSTox Substance ID: DTXSID60403952
• Nikkaji Number: J379.576D
• Wikipedia: 1,1,1-Tris(aminomethyl)ethane
• Wikidata: Q15410166
• Mol file: 15995-42-3.mol

Synonyms:15995-42-3;2-(Aminomethyl)-2-methyl-1,3-propanediamine;2-(aminomethyl)-2-methylpropane-1,3-diamine;1,1,1-Tris(aminomethyl)ethane;1,3-Propanediamine, 2-(aminomethyl)-2-methyl-;Ethylidynetrismethaneamine;SCHEMBL712414;DTXSID60403952;UGDSCHVVUPHIFM-UHFFFAOYSA-N;AKOS006342350;EN300-1425622;Q15410166;2-(Aminomethyl)-2-methyl-1,3-propanediamine, >=95.0% (GC)

Chemical Property of 2-(Aminomethyl)-2-methyl-1,3-propanediamine

Chemical Property:

• Boiling Point: 264.1±8.0 °C(Predicted)
• PKA: 10.11±0.15(Predicted)
• PSA: 78.06000
• Density: 0.959±0.06 g/cm3(Predicted)
• LogP: 0.96970
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 117.126597491
• Heavy Atom Count: 8
• Complexity: 50.4

Purity/Quality:

99% ^*data from raw suppliers

2-(AMINOMETHYL)-2-METHYL-1,3-PROPANEDIAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CN)(CN)CN

Technology Process of 2-(Aminomethyl)-2-methyl-1,3-propanediamine

There total 7 articles about 2-(Aminomethyl)-2-methyl-1,3-propanediamine 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: 97.0%

→ 1,1,1-Tris(aminomethyl)ethane (15995-42-3)

Guidance literature:

Reference yield: 86.0%

α,α,α-tris(azidomethyl)ethane (31044-86-7) → 1,1,1-Tris(aminomethyl)ethane (15995-42-3)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 24h;

DOI:10.1139/v98-030

Reference yield: 70.0%

N,N',N''-tris(phthalimide) (87448-40-6) → 1,1,1-Tris(aminomethyl)ethane (15995-42-3)

Guidance literature:

With potassium hydroxide; In water; at 180 ℃; for 20h;

DOI:10.1016/S0022-328X(98)00717-7

upstream raw materials:

N,N',N''-tris(phthalimide)

α,α,α-tris(azidomethyl)ethane

ethylidynetris(methyl) tris(benzenesulfonate)

N,N'-(2-hydroxymethyl-2-methylpropane-1,3-diyl)bis(phthalimide)

Downstream raw materials:

1-Methyl-3,5,7-triazatricyclo<3.3.1.1³.7>decan

C₂₉H₃₃N₃O₆

C₃₂H₃₉N₃O₉

CH₃C(CH₂NHCOC₆H₃(OH)2)3