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Desmorapid
CAS: 15875-13-5 | C18H42N6
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
15875-13-5
Molecular Formula:
C18H42N6
Molecular Mass:
342.58 g/mol
Names and Synonyms:
Desmorapid
1,3,5-Triazine-1,3,5(2H,4H,6H)-tripropanamine, N1,N1,N3,N3,N5,N5-hexamethyl-
s-Triazine, 1,3,5-tris[3-(dimethylamino)propyl]hexahydro-
1,3,5-Triazine-1,3,5(2H,4H,6H)-tripropanamine, N,N,N′,N′,N′′,N′′-hexamethyl-
N1,N1,N3,N3,N5,N5-Hexamethyl-1,3,5-triazine-1,3,5(2H,4H,6H)-tripropanamine
N,N′,N′′-Tris(dimethylaminopropyl)-sym-hexahydrotriazine
1,3,5-Tris(N,N-dimethyl-3-aminopropyl)-s-hexahydrotriazine
N,N′,N′′-Tris(dimethylaminopropyl)-s-hexahydrotriazine
1,3,5-Tris[3-(dimethylamino)propyl]-s-hexahydrotriazine
Polycat 41
1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine
Desmorapid
Tris(dimethylaminopropyl)-s-hexahydrotriazine
N,N′,N′′-Tris(3-dimethylaminopropyl)hexahydro-s-triazine
R 141
Polycat P 41
Kaolizer 14
Toyocat TRC
Niax C 41
Minico R 141
1,3,5-Tri(3-dimethylaminopropyl)hexahydro-1,3,5-triazine
NSC 28833
Lupragen N 600
N 600
2,4,6-Tris[(3-dimethylamino)propyl]hexahydrotriazine
Jeffcat TR 90
TR 90
Niax Catalyst C 41
PC 41
PC CAT NP 40
Tris(3-dimethylaminopropyl)hexahydro-s-triazine
Tegoamin 41
N,N,N′,N′,N′′,N′′-Hexamethyl-1,3,5-triazine-1,3,5(2H,4H,6H)-tripropanamine
Lupragen 600
Identifiers:
SMILES:
CN(C)CCCN1CN(CCCN(C)C)CN(CCCN(C)C)C1
InChI:
InChI=1S/C18H42N6/c1-19(2)10-7-13-22-16-23(14-8-11-20(3)4)18-24(17-22)15-9-12-21(5)6/h7-18H2,1-6H3
Key Properties
Boiling Point
135-140 °C @ Press: 0.01 Torr
CAS Common Chemistry
Melting Point
268-271 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 342.58 g/mol | CAS Common Chemistry |
| 342.57600000000014 g/mol | RDKit | |
| 342.34709534399997 g/mol | RDKit | |
| Boiling Point | 135-140 °C @ Press: 0.01 Torr | CAS Common Chemistry |
| Canonical SMILES | N(C)(C)CCCN1CN(CN(C1)CCCN(C)C)CCCN(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C18H42N6/c1-19(2)10-7-13-22-16-23(14-8-11-20(3)4)18-24(17-22)15-9-12-21(5)6/h7-18H2,1-6H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FZQMJOOSLXFQSU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 268-271 °C | CAS Common Chemistry |
| Name | Desmorapid | CAS Common Chemistry |
| Heavy Atom Count | 24 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 12 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 19.440000000000005 Ų | RDKit |
| LogP | 0.6336000000000044 | RDKit |
| Molar Refractivity | 104.23200000000008 | RDKit |
