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Molecule
Aminol
CAS: 2008-39-1 · C10H13Cl2NO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 2008-39-1
- Molecular Formula
- C10H13Cl2NO3
- Molecular Mass
- 266.12 g/mol
Identifiers
CAS Registry Number
2008-39-1
SMILES
CNC.O=C(O)COc1ccc(Cl)cc1Cl
InChI Key
IUQJDHJVPLLKFL-UHFFFAOYSA-N
InChI
InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3
Names and Synonyms
- Aminol Common Name
- Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with N-methylmethanamine (1:1) Synonym
- Acetic acid, (2,4-dichlorophenoxy)-, compd. with dimethylamine (1:1) Synonym
- Acetic acid, (2,4-dichlorophenoxy)-, compd. with N-methylmethanamine (1:1) Synonym
- Acetic acid, (2,4-dichlorophenoxy)-, compd. with Me2NH Synonym
- Acetic acid, (2,4-dichlorophenoxy)-, salt with Me2NH Synonym
- Dimethylamine, (2,4-dichlorophenoxy)acetate Synonym
- Methanamine, N-methyl-, (2,4-dichlorophenoxy)acetate Synonym
- (2,4-Dichlorophenoxy)acetic acid dimethylamine Synonym
- 2,4-D dimethylamine salt Synonym
- 2,4-D dimethylamine Synonym
- Dimethylammonium (2,4-dichlorophenoxy)acetate Synonym
- (2,4-Dichlorophenoxy)acetic acid dimethylamine salt Synonym
- Hormin Synonym
- 2,4-D Amine salt Synonym
- Bladex G Synonym
- 2,4-D amine Synonym
- Phordene Synonym
- Formula 40 Synonym
- 2,4-D DMA Synonym
- Monosan Synonym
- DMA 4 Synonym
- DMA 4 (pesticide) Synonym
- Aminol Synonym
- Aminol (herbicide) Synonym
- Weedar 96 Synonym
- Farmco D 50 Synonym
- D 50 (pesticide) Synonym
- D 50 Synonym
- Aminopielik 39 Synonym
- Brabant 2,4-D amine Synonym
- Dikamin D Synonym
- Spraygraze Synonym
- U 46D Fluid Synonym
- Shirweed 500 Synonym
- Spritz-Hormin Synonym
- Amisol Synonym
- Weedar 64 Synonym
- Clean Crop 2,4-D Amine 500 Synonym
- Wilbur-Ellis 2,4-D Amine 500 Synonym
- Aminopielik 600SL Synonym
- DMA 6 Synonym
- Aminopielek 720 Synonym
- Amicide Synonym
- Amin'a Synonym
- Aminopielik Standard 4600SL Synonym
- Aminopielik Standard 600SL Synonym
- Aminopielik Standard Synonym
- Luvaram Synonym
- Agro D amine Synonym
- Cornox amine Synonym
- DMA 806BR Synonym
- Savage Synonym
- Depitox Synonym
- Agrisolution Synonym
- Herboxon Synonym
- 2,4-D dimethylammonium salt Synonym
- Weedar Synonym
- WAM 40 Synonym
- Base Camp Amine 4 Synonym
- WEEDestroy AM-40 Synonym
- DMA 4 IVM Synonym
- 2,4-Dichlorophenoxyacetic acid dimethylamine salt Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 266.12 g/mol | CAS Common Chemistry |
| 266.124 g/mol | RDKit | |
| 266.118 g/mol | chempirical lib | |
| Canonical SMILES | O=C(O)COC1=CC=C(Cl)C=C1Cl.N(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=IUQJDHJVPLLKFL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 85-87 °C | CAS Common Chemistry |
| Name | Aminol | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 58.56 Ų | RDKit |
| LogP | 2.2923999999999998 | RDKit |
| 2.2924 | RDKit | |
| Molar Refractivity | 64.57650000000002 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.3 | RDKit |
| Exact Mass | 265.027248636 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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.
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MW = 266.12 g/mol. Edit any field — others recompute live.
