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15875-13-5

15875-13-5 Structure

15875-13-5 Structure
IdentificationMore
[Name]

1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine
[CAS]

15875-13-5
[Synonyms]

1,3,5-TRIS[3-(DIMETHYLAMINO)PROPYL]HEXAHYDRO-1,3,5-TRIAZINE
1,3,5-TRIS(3-DIMETHYLAMINOPROPYL)HEXAHYDRO-S-TRIAZINE
1,3,5-TRIS(DIMETHYLAMINOPROPYL)HEXAHYDRO-S-TRIAZINE
LUPRAGEN(R) N 600
n,n,n',n',n'',n''-hexamethyl-1,3,5-triazine-1,3,5(2h,4h,6h)-tripropanamine
N,N',N''-TRIS(DIMETHYLAMINOPROPYL) HEXAHYDROTRIAZINE
1,3,5-tris(3-(dimethylamino)propyl)hexahydro-s-triazin
3,5-Triazine-1,3,5(2H,4H,6H)-tripropanamine,N,N,N’,N’,N’’,N’’-hexamethyl-1
5-triazine-1,3,5(2h,4h,6h)-tripropanamine,n,n,n’,n’,n’’,n’’-hexamethyl-3
desmorapid
hexahydro-1,3,5-tris(dimethylaminopropyl)-s-triazin
kaolizer14
n,n’,n’’-tris(dimethylaminopropyl)-s-hexahydrotriazine
niaxc41
polycat41
polycatp41
r141
r141(catalyst)
toyocattrc
1,3,5-Tris-(dimethylaminopropyl)-1,3,5-hexahydrotriazine
[EINECS(EC#)]

240-004-1
[Molecular Formula]

C18H42N6
[MDL Number]

MFCD00059766
[Molecular Weight]

342.57
[MOL File]

15875-13-5.mol
Chemical PropertiesBack Directory
[Melting point ]

268-271 °C
[Boiling point ]

141-142°C
[density ]

0.92
[vapor pressure ]

5.332hPa at 21.1℃
[refractive index ]

1.478
[Fp ]

>110°C
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

transparent viscous liquid
[pka]

10.00±0.28(Predicted)
[color ]

Colorless to light yellow
[Water Solubility ]

590g/L at 25℃
[LogP]

0.26 at 25℃
[CAS DataBase Reference]

15875-13-5(CAS DataBase Reference)
[EPA Substance Registry System]

15875-13-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R21:Harmful in contact with skin.
R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

2735
[RTECS ]

XY9491300
Hazard InformationBack Directory
[Uses]

1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine is a moderately active trimerisation catalyst. It has very good foaming ability. It has very good performance in water co-blown rigid systems. It can be widely used in rigid polyurethanes, polyisocyanurate foams and non-foams.
[Synthesis]

Formaldehyde

50-00-0

3-Dimethylaminopropylamine

109-55-7

1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine

15875-13-5

General procedure for the synthesis of tris(dimethylaminopropyl)hexahydrotriazine from formaldehyde and N,N-dimethyl-1,3-diaminopropane: To a 125 mL round-bottomed flask was added a solution of N,N-dimethylpropane-1,3-diamine (6.29 mL, 50 mmol) in toluene (15 mL), followed by paraformaldehyde (1.652 g, 55 mmol, 1.1 eq.) . A Dean-Stark manifold was installed and the reaction mixture was refluxed for 1.5 hours. After completion of the reaction, toluene was removed by evaporation. A portion of the residue (1.9757 g) was taken and partitioned between chloroform (15 mL) and water (5 mL). The organic layer was separated, dried over anhydrous magnesium sulfate and concentrated to give a clarified oily product. The product yield was 66% (1.3067 g). Thin layer chromatography (TLC) analytical conditions: unfolding agent was a 20% ethyl acetate solution of methanol (10 mL) with an Rf value of 0.05. Nuclear magnetic resonance hydrogen spectrum (1H NMR, 400 MHz, CDCl3, δ): 3.29 (broad peak, 6H, H5), 2.40 (triple peak, 6H, J = 7.5 Hz, H4), 2.25 (triple peak, 6H, J = 7.5 Hz, H3), 2.18 (single peak, 18H, H2), 1.59 (multiple peaks, 6H, J = 7.5 Hz, H1) ppm. nuclear magnetic resonance carbon spectrum (13C NMR, 100 MHz, CDCl3, δ): 74.65 (C5), 57.83 (C3), 50.78 (C4), 45.54 (C2), 25.88 ( C1) ppm.

[References]

[1] Patent: WO2014/127451, 2014, A1. Location in patent: Page/Page column 53; 54
[2] Patent: WO2004/43938, 2004, A1. Location in patent: Page 4
Spectrum DetailBack Directory
[Spectrum Detail]

1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine(15875-13-5)1HNMR
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