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| Name |
N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt |
EINECS | N/A |
| CAS No. | 82611-88-9 | Density | N/A |
| PSA | 78.05000 | LogP | 2.53760 |
| Solubility | Soluble | Melting Point |
N/A |
| Formula | C12H18NO4SNa | Boiling Point | N/A |
| Molecular Weight | 295.33 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | 36 | Risk Codes | 20/21/22 |
| Molecular Structure |
|
Hazard Symbols |
 Xn
|
| Synonyms |
1-Propanesulfonicacid, 3-[ethyl(3-methoxyphenyl)amino]-, sodium salt (9CI);ADPS; |
N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt Chemical Properties
Product Name: 1-Propanesulfonic acid,3-[ethyl(3-methoxyphenyl)amino]-, sodium salt (1:1)
Systematic of 1-Propanesulfonic acid,3-[ethyl(3-methoxyphenyl)amino]-, sodium salt (1:1) (CAS NO.82611-88-9): N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt ; ADPS
CAS NO: 82611-88-9
Molecular Formula of 1-Propanesulfonic acid,3-[ethyl(3-methoxyphenyl)amino]-, sodium salt (1:1) (CAS NO.82611-88-9): C12H18NO4SNa
Molecular Weight: 295.33
Molecular Structure:
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Product Categories: Organic Building Blocks;Sulfonic/Sulfinic Acid Salts;Sulfur Compounds
H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area of 1-Propanesulfonic acid,3-[ethyl(3-methoxyphenyl)amino]-, sodium salt (1:1) (CAS NO.82611-88-9): 75.22 Å2
SMILES: [Na+].COc1cccc(c1)N(CC)CCCS(O)(=O)=O
InChI: InChI=1/C12H19NO4S.Na/c1-3-13(8-5-9-18(14,15)16)11-6-4-7-12(10-11)17-2;/h4,6-7,10H,3,5,8-9H2,1-2H3,(H,14,15,16);/q;+1
InChIKey: MWFOPMKUGZLPQA-UHFFFAOYAU
Std. InChI: InChI=1S/C12H19NO4S.Na/c1-3-13(8-5-9-18(14,15)16)11-6-4-7-12(10-11)17-2;/h4,6-7,10H,3,5,8-9H2,1-2H3,(H,14,15,16);/q;+1
Std. InChIKey: MWFOPMKUGZLPQA-UHFFFAOYSA-N
N-Ethyl-N-(3-sulfopropyl)-3-methoxyaniline sodium salt Safety Profile
Hazard Codes: 
Xn
Risk Statements: 20/21/22
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 36
S36: Wear suitable protective clothing.
WGK Germany: 3
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