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Triallyl Isocyanurate
CAS: 1025-15-6 | C12H15N3O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1025-15-6
Molecular Formula:
C12H15N3O3
Molecular Weight:
249.26999999999995 g/mol
Names and Synonyms:
Triallyl Isocyanurate
Common Name
Farida TAIC-P
Synonym
1,3,5-Triallyl-1,3,5-triazinane-2,4,6-trione
Synonym
Kettlitz TAIC
Synonym
Trilink 7
Synonym
HBSQ 2011
Synonym
Luvomaxx TAIC-DL 70C
Synonym
Triallylisocyanuric acid
Synonym
SR 533R
Synonym
TAIC WH
Synonym
DLC-A
Synonym
TAIC-M 60
Synonym
Triallyl isocyanurate
Synonym
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tri-2-propen-1-yl-
Synonym
T-CROS
Synonym
A 1712
Synonym
Taic-S 70
Synonym
1,3,5-Triallyl-1,3,5-triazin-2,4,6-trione
Synonym
TAIC-B
Synonym
Rhenofit TAIC/S
Synonym
PL 301-50D
Synonym
Luvomaxx TAIC-DL 70
Synonym
TAIC 60
Synonym
M 6
Synonym
TAIC-M 6
Synonym
Perkalink 301-50
Synonym
Triallyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
Synonym
Perkalink 301
Synonym
1,3,5-Tri-2-propen-1-yl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
Synonym
s-Triazine-2,4,6(1H,3H,5H)-trione, triallyl-
Synonym
s-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-triallyl-
Synonym
Drimix TAIC 75
Synonym
CVD 50106
Synonym
1,3,5-Tris(2-propenyl) isocyanurate
Synonym
PL 301
Synonym
TAIC 70
Synonym
Betalink IC/W 65PA6
Synonym
Perkalink 301-70DPD
Synonym
Nor-TAIC KS
Synonym
1,3,5-Tris-2′-propenylisocyanuric acid
Synonym
NSC 11692
Synonym
Drimix TAIC
Synonym
1,3,5-Triallyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
Synonym
Perkalink 301-501
Synonym
1,3,5-Tri-2-propenyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
Synonym
M 60
Synonym
M 60 (isocyanurate)
Synonym
TAIC
Synonym
Diak 7
Synonym
1,3,5-Triallylisocyanurate
Synonym
1,3,5-Triallyl-1,3,5-triazine-2,4,6-trione
Synonym
Allyl isocyanurate
Synonym
T 123406
Synonym
TAIC-S
Synonym
Daik 7
Synonym
Triallyl-1,3,5-triazine-2,4,6-trione
Synonym
Taicros
Synonym
TAIC 100
Synonym
Synpro PLC 4185
Synonym
TAIC-WH 60
Synonym
TAIC DLC-A
Synonym
SR 533
Synonym
WH 60
Synonym
M 6 (isocyanurate)
Synonym
Perkalink 301-50D
Synonym
1,3,5-Triallylisocyanuric acid
Synonym
Isocyanuric acid triallyl ester
Synonym
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tri-2-propenyl-
Synonym
Identifiers:
SMILES:
C=CCn1c(=O)n(CC=C)c(=O)n(CC=C)c1=O
InChI:
InChI=1S/C12H15N3O3/c1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17/h4-6H,1-3,7-9H2
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 249.26999999999995 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 249.11134134 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 18 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 6 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 6 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 66.0 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.27030000000000043 | RDKit |
| molecular_mass | 249.27 g/mol | Legacy Database |
| density | 1.38 g/cm³ | Legacy Database |
| cas-boiling-point | 107-114 °C @ Press: 0.5 Torr None | Legacy Database |
| cas-canonical-smile | O=C1N(C(=O)N(C(=O)N1CC=C)CC=C)CC=C None | Legacy Database |
| cas-density | 1.382 g/cm3 @ Temp: 22 °C None | Legacy Database |
| cas-inchi | InChI=1S/C12H15N3O3/c1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17/h4-6H,1-3,7-9H2 None | Legacy Database |
| cas-inchi-key | InChIKey=KOMNUTZXSVSERR-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 20.5 °C None | Legacy Database |
| cas-name | Triallyl isocyanurate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 69.813 | RDKit |