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Molecule
Desmorapid
CAS: 15875-13-5 · C18H42N6
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 15875-13-5
- Molecular Formula
- C18H42N6
- Molecular Mass
- 342.58 g/mol
Identifiers
CAS Registry Number
15875-13-5
SMILES
CN(C)CCCN1CN(CCCN(C)C)CN(CCCN(C)C)C1
InChI Key
FZQMJOOSLXFQSU-UHFFFAOYSA-N
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
Names and Synonyms
- Desmorapid Synonym
- 1,3,5-Triazine-1,3,5(2H,4H,6H)-tripropanamine, N1,N1,N3,N3,N5,N5-hexamethyl- Synonym
- s-Triazine, 1,3,5-tris[3-(dimethylamino)propyl]hexahydro- Synonym
- 1,3,5-Triazine-1,3,5(2H,4H,6H)-tripropanamine, N,N,N′,N′,N′′,N′′-hexamethyl- Synonym
- N1,N1,N3,N3,N5,N5-Hexamethyl-1,3,5-triazine-1,3,5(2H,4H,6H)-tripropanamine Synonym
- N,N′,N′′-Tris(dimethylaminopropyl)-sym-hexahydrotriazine Synonym
- 1,3,5-Tris(N,N-dimethyl-3-aminopropyl)-s-hexahydrotriazine Synonym
- N,N′,N′′-Tris(dimethylaminopropyl)-s-hexahydrotriazine Synonym
- 1,3,5-Tris[3-(dimethylamino)propyl]-s-hexahydrotriazine Synonym
- Polycat 41 Synonym
- 1,3,5-Tris[3-(dimethylamino)propyl]hexahydro-1,3,5-triazine Synonym
- Desmorapid Synonym
- Tris(dimethylaminopropyl)-s-hexahydrotriazine Synonym
- N,N′,N′′-Tris(3-dimethylaminopropyl)hexahydro-s-triazine Synonym
- R 141 Synonym
- Polycat P 41 Synonym
- Kaolizer 14 Synonym
- Toyocat TRC Synonym
- Niax C 41 Synonym
- Minico R 141 Synonym
- 1,3,5-Tri(3-dimethylaminopropyl)hexahydro-1,3,5-triazine Synonym
- NSC 28833 Synonym
- Lupragen N 600 Synonym
- N 600 Synonym
- 2,4,6-Tris[(3-dimethylamino)propyl]hexahydrotriazine Synonym
- Jeffcat TR 90 Synonym
- TR 90 Synonym
- Niax Catalyst C 41 Synonym
- PC 41 Synonym
- PC CAT NP 40 Synonym
- Tris(3-dimethylaminopropyl)hexahydro-s-triazine Synonym
- Tegoamin 41 Synonym
- N,N,N′,N′,N′′,N′′-Hexamethyl-1,3,5-triazine-1,3,5(2H,4H,6H)-tripropanamine Synonym
- Lupragen 600 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 342.58 g/mol | CAS Common Chemistry |
| 342.57600000000014 g/mol | RDKit | |
| 342.576 g/mol | RDKit | |
| 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 |
| 19.44 Ų | RDKit | |
| 18.06 Ų | chempirical lib | |
| LogP | 0.6336000000000044 | RDKit |
| 0.6336 | RDKit | |
| Molar Refractivity | 104.23200000000008 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 342.34709534399997 g/mol | RDKit |
| Boiling Point | 135-140 °C @ 0.01 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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140
120
100
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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.
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MW = 342.58 g/mol. Edit any field — others recompute live.
