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Aminol
CAS: 2008-39-1 | C10H13Cl2NO3
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
2008-39-1
Molecular Formula:
C10H13Cl2NO3
Molecular Mass:
266.12 g/mol
Names and Synonyms:
Aminol
Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with N-methylmethanamine (1:1)
Acetic acid, (2,4-dichlorophenoxy)-, compd. with dimethylamine (1:1)
Acetic acid, (2,4-dichlorophenoxy)-, compd. with N-methylmethanamine (1:1)
Acetic acid, (2,4-dichlorophenoxy)-, compd. with Me2NH
Acetic acid, (2,4-dichlorophenoxy)-, salt with Me2NH
Dimethylamine, (2,4-dichlorophenoxy)acetate
Methanamine, N-methyl-, (2,4-dichlorophenoxy)acetate
(2,4-Dichlorophenoxy)acetic acid dimethylamine
2,4-D dimethylamine salt
2,4-D dimethylamine
Dimethylammonium (2,4-dichlorophenoxy)acetate
(2,4-Dichlorophenoxy)acetic acid dimethylamine salt
Hormin
2,4-D Amine salt
Bladex G
2,4-D amine
Phordene
Formula 40
2,4-D DMA
Monosan
DMA 4
DMA 4 (pesticide)
Aminol
Aminol (herbicide)
Weedar 96
Farmco D 50
D 50 (pesticide)
D 50
Aminopielik 39
Brabant 2,4-D amine
Dikamin D
Spraygraze
U 46D Fluid
Shirweed 500
Spritz-Hormin
Amisol
Weedar 64
Clean Crop 2,4-D Amine 500
Wilbur-Ellis 2,4-D Amine 500
Aminopielik 600SL
DMA 6
Aminopielek 720
Amicide
Amin'a
Aminopielik Standard 4600SL
Aminopielik Standard 600SL
Aminopielik Standard
Luvaram
Agro D amine
Cornox amine
DMA 806BR
Savage
Depitox
Agrisolution
Herboxon
2,4-D dimethylammonium salt
Weedar
WAM 40
Base Camp Amine 4
WEEDestroy AM-40
DMA 4 IVM
2,4-Dichlorophenoxyacetic acid dimethylamine salt
Identifiers:
SMILES:
CNC.O=C(O)COc1ccc(Cl)cc1Cl
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
Key Properties
Melting Point
85-87 °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 | 266.12 g/mol | CAS Common Chemistry |
| 266.124 g/mol | RDKit | |
| 265.027248636 g/mol | RDKit | |
| 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 |
| Molar Refractivity | 64.57650000000002 | RDKit |
