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Merck
CN

337722

1,3,5-Tribenzylhexahydro-1,3,5-triazine

98%

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About This Item

Empirical Formula (Hill Notation):
C24H27N3
CAS Number:
2547-66-2
Molecular Weight:
357.49
NACRES:
NA.22
PubChem Substance ID:
24860495
UNSPSC Code:
12352100
EC Number:
219-831-7
MDL number:
MFCD00014599

Key Documents

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Product Name

1,3,5-Tribenzylhexahydro-1,3,5-triazine, 98%

InChI key

VWVZIRPJPFJGFE-UHFFFAOYSA-N

InChI

1S/C24H27N3/c1-4-10-22(11-5-1)16-25-19-26(17-23-12-6-2-7-13-23)21-27(20-25)18-24-14-8-3-9-15-24/h1-15H,16-21H2

SMILES string

C1N(CN(CN1Cc2ccccc2)Cc3ccccc3)Cc4ccccc4

assay

98%

form

solid

bp

100 °C/0.005 mmHg (lit.)

mp

49-51 °C (lit.)

functional group

phenyl

Application

1,3,5-Tribenzylhexahydro-1,3,5-triazine was used:
  • in the synthesis of alkyl β-aminocarboxylates via trifluoromethanesulfonic acid catalyzed reaction with ketene silyl acetals
  • as ligand to study the assembling process of a heterogeneous Cr-based single-site ethylene trimerization catalyst by X-ray absorption spectroscopy
  • as ligand during conversion of Phillips Cr/SiO2 polymerisation catalyst to ethylene trimerisation catalyst after assembling new active sites on the silica surface

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
0000109590
0000065088
0000035836
06807DJ
10619DE

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Trifluoromethanesulfonic acid-promoted reaction of hexahydro-1, 3, 5-triazines with ketene silyl acetals. convenient synthesis of alkyl ?-aminocarboxylates.
Ikeda K, et al.
Tetrahedron Letters, 24(9), 913-916 (1983)
Cristina N Nenu et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 12(18), 4756-4763 (2006-04-07)
X-ray absorption spectroscopy at the Cr K- and L(2,3)-edges was used to study the assembling process of a heterogeneous Cr-based single-site catalyst. The starting point was a Phillips-type system with monochromate species anchored on a silica surface, which was first
Turning a Cr-based heterogeneous ethylene polymerisation catalyst into a selective ethylene trimerisation catalyst.
Nenu CN, et al.
J. Mol. Catal. A: Chem., 269(1), 5-11 (2007)

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