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| CAS No.: | 3926-62-3 |
|---|---|
| Name: | Chloroacetic acid sodium salt |
| Article Data: | 16 |
| Molecular Structure: | |
|
|
|
| Formula: | C2H3ClO2Na |
| Molecular Weight: | 116.479 |
| Synonyms: | Aceticacid, chloro-, sodium salt (8CI,9CI);Chloroacetic acid sodium salt;Monochloroacetic acid sodium salt;SMA;SMA (herbicide);Sodium2-chloroacetate;Sodiummonochloroacetate;Sodium a-chloroacetate; |
| EINECS: | 223-498-3 |
| Density: | 1.399 g/cm3 |
| Melting Point: | 199 °C (dec.)(lit.) |
| Boiling Point: | 189 °C at 760 mmHg |
| Flash Point: | 71.5 °C |
| Solubility: | 440 g/L (20 °C) in water |
| Appearance: | white crystalline powder |
| Hazard Symbols: |
 T,  N
|
| Risk Codes: | 25-38-50 |
| Safety: | 22-37-45-61 |
| Transport Information: | UN 2659 6.1/PG 3 |
| PSA: | 40.13000 |
| LogP: | -1.02490 |
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| Conditions | Yield |
|---|---|
| With KB-4P-2(Na) Equilibrium constant; exchange equilibrium constant; | |
| With sodium carbonate In water at 45℃; | |
| With sodium carbonate In water |
| Conditions | Yield |
|---|---|
| In water |
- 3926-62-3
sodium monochloroacetic acid
- 832151-92-5
(R)-1-chloro-3-(tert-butyldimethylsilyloxy)butan-2-one
| Conditions | Yield |
|---|---|
| Stage #1: sodium monochloroacetic acid; (R)-ethyl 2-((tert-butyldimethylsilyl)oxy)propanoate With tert-butylmagnesium chloride; triethylamine In tetrahydrofuran at 0℃; for 4h; Stage #2: With hydrogenchloride In tetrahydrofuran; water at 25℃; for 2h; pH=6.0; | 100% |
- 3926-62-3
sodium monochloroacetic acid
| Conditions | Yield |
|---|---|
| With tert-butylmagnesium chloride; triethylamine In tetrahydrofuran at -5 - 10℃; Inert atmosphere; | 100% |
- 53008-65-4
methyl 2,3,4-tri-O-benzyl-D-glucopyranoside
- 3926-62-3
sodium monochloroacetic acid
| Conditions | Yield |
|---|---|
| Stage #1: methyl 2,3,4-tri-O-benzyl-D-glucopyranoside With sodium hydride In N,N-dimethyl-formamide at 0℃; Stage #2: sodium monochloroacetic acid at 0 - 20℃; for 0.166667h; | 100% |
| Conditions | Yield |
|---|---|
| In ethanol; water at 78℃; for 24h; Inert atmosphere; | 99% |
- 105198-38-7, 106513-42-2
ethyl (S)-2-(tert-butyldimethylsilyloxy)propanoate
- 3926-62-3
sodium monochloroacetic acid
- 156093-90-2
(S)-3-[(tert-butyldimethyl)silyloxy]-1-chlorobutan-2-one
| Conditions | Yield |
|---|---|
| Stage #1: ethyl (S)-2-(tert-butyldimethylsilyloxy)propanoate; sodium monochloroacetic acid With tert-butylmagnesium chloride; triethylamine In tetrahydrofuran at 0℃; for 4h; Stage #2: With hydrogenchloride In tetrahydrofuran; water pH=6.0; | 98% |
- 96-29-7
ethyl methyl ketone oxime
- 3926-62-3
sodium monochloroacetic acid
- 98548-96-0
2-[(butan-2-ylideneamino)oxy]ethanoic acid
| Conditions | Yield |
|---|---|
| With potassium hydroxide In water; acetone at 20 - 60℃; for 2.25h; Solvent; Temperature; | 98% |
| Conditions | Yield |
|---|---|
| In ethanol; diethylperfluoroethylamine at 70 - 78℃; for 4h; | 97.5% |
- 216659-47-1
(3-dimethylamino-propyl)-carbamic acid 1,1-dimethylethyl ester
- 3926-62-3
sodium monochloroacetic acid
- 918106-95-3
C12H24N2O4
| Conditions | Yield |
|---|---|
| In water; tert-butyl alcohol at 80℃; for 8h; | 97.3% |
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- Total:24 Page 1 of 1 1
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Chemistry
Molecular Structure of Sodium chloroacetate (CAS NO.3926-62-3):
IUPAC Name: sodium 2-chloroacetate
Molecular formula: C2H2ClNaO2
Molecular Weight: 116.48
EINECS: 223-498-3
Merck: 14,2112
BRN: 3597157
Boiling Point: 189 °C at 760 mmHg
Flash Point: 71.5 °C
Enthalpy of Vaporization: 46.87 kJ/mol
Vapour Pressure: 0.259 mmHg at 25°C
Water Solubility: 440 g/L (20°C)
Melting point: 199 °C (dec.)(lit.)
Sensitive: Hygroscopic
InChI
InChI=1/C2H3ClO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1
Smiles
[O-]C(CCl)=O.[Na+]
Stability: Stable. Incompatible with strong oxidizing agents.
Classification Code: Agricultural Chemical; Growth regulator / Fertilizer; Herbicide; Out-dated pesticide
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| bird - domestic | LDLo | oral | 100mg/kg (100mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: COMA GASTROINTESTINAL: OTHER CHANGES | Acta Pharmacologica et Toxicologica. Vol. 18, Pg. 179, 1961. |
| chicken | LD50 | oral | 81mg/kg (81mg/kg) | Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 1047, 1966. | |
| guinea pig | LD50 | intraperitoneal | 115mg/kg (115mg/kg) | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(12), Pg. 53, 1987. | |
| guinea pig | LD50 | oral | 99mg/kg (99mg/kg) | Journal of Industrial Hygiene and Toxicology. Vol. 23, Pg. 78, 1941. | |
| mammal (species unspecified) | LDLo | oral | 150mg/kg (150mg/kg) | BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Nordisk Veterinaermedicin Danske Udgave. Vol. 13, Pg. 271, 1961. |
| mouse | LD50 | oral | 165mg/kg (165mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 336, 1946. | |
| rabbit | LD50 | oral | 156mg/kg (156mg/kg) | Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 1047, 1966. | |
| rat | LD50 | oral | 95mg/kg (95mg/kg) | Journal of Industrial Hygiene and Toxicology. Vol. 23, Pg. 78, 1941. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of Cl− and Na2O. Used as an herbicide.
The Hazard Codes: 
T, 
N
HazardClass: 6.1
Risk Statements information:
25: Toxic if swallowed
38: Irritating to the skin
50: Very Toxic to aquatic organisms
Safety Statements information:
22: Do not breathe dust
37: Wear suitable gloves
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
61: Avoid release to the environment. Refer to special instructions safety data sheet
RIDADR: UN 2659 6.1/PG 3
RTECS: AG1400000
PackingGroup: III
HS Code: 29154000
WGK Germany: 2
Standards and Recommendations
DOT Classification: 6.1; Label: KEEP AWAY FROM FOOD
Specification
Sodium chloroacetate , with CAS number of 3926-62-3, can be called Caswell No. 755A ; Chloroacetic acid sodium salt ; Chloroctan sodny ; Monoxone ; Sodium monochloroacetate . Sodium chloroacetate (CAS NO.3926-62-3) is used for pesticide, medicine and other organic synthesis.