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| CAS No.: | 305-53-3 |
|---|---|
| Name: | IODOACETIC ACID SODIUM SALT |
| Molecular Structure: | |
|
|
|
| Formula: | C2H2IO2.Na |
| Molecular Weight: | 207.931 |
| Synonyms: | Aceticacid, iodo-, sodium salt (8CI,9CI);Iodoacetic acid sodium salt;Sodium monoiodoacetate; |
| EINECS: | 206-165-7 |
| Melting Point: | 208 °C (dec.)(lit.) |
| Boiling Point: | 262.1 °C at 760 mmHg |
| Flash Point: | 112.3 °C |
| Solubility: | methanol: 0.1 M at 20 °C, clear, colorless |
| Appearance: | light yellow to yellow-brown powder |
| Hazard Symbols: |
 T,  Xn
|
| Risk Codes: | 25-37/38-41-20/21/22 |
| Safety: | 26-39-45-36 |
| Transport Information: | UN 2811 6.1/PG 1 |
| PSA: | 40.13000 |
| LogP: | -0.82870 |
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N,N'-bis(2-mercaptoethyl)-1,4-diazacycloheptane cobalt(II) dimer
- 305-53-3
monosodium iodoacetate
| Conditions | Yield |
|---|---|
| In methanol at 20℃; for 24h; Inert atmosphere; Schlenk technique; | 98% |
- 80735-94-0
1-Phenyl-3-buten-1-ol
- 305-53-3
monosodium iodoacetate
- 257949-88-5
4-Phenyl-3-oxahept-6-enoic acid
| Conditions | Yield |
|---|---|
| Stage #1: 1-Phenyl-3-buten-1-ol With sodium hydride In tetrahydrofuran for 1h; Metallation; Stage #2: monosodium iodoacetate for 2h; Alkylation; Esterification; Heating; | 95% |
| 1.) THF, 2.) reflux, 2 h; Yield given. Multistep reaction; |
- 138750-71-7, 125877-82-9
(2'R,3'S)-<3'-(tert-butyldimethylsilyloxy)tetrahydropyran-2'-yl>methanol
- 305-53-3
monosodium iodoacetate
- 864719-87-9
2-{[(2R,3S)-3-(tert-butyldimethylsilyloxy)-tetrahydro-2H-pyran-2-yl]methoxy}acetic acid
| Conditions | Yield |
|---|---|
| With sodium hydride In tetrahydrofuran at 0 - 20℃; | 95% |
| With sodium hydride In tetrahydrofuran | 95% |
| With sodium hydride In tetrahydrofuran |
- 81028-03-7
(Z)-4-benzyloxy-but-2-en-1-ol
- 305-53-3
monosodium iodoacetate
- 861997-65-1
(Z)-(4-benzyloxybut-2-enyloxy)acetic acid
| Conditions | Yield |
|---|---|
| With n-butyllithium In tetrahydrofuran; hexane at -78 - 20℃; | 95% |
- 305-53-3
monosodium iodoacetate
- 740845-32-3
[(2R,3R)-3-(tert-butyldimethylsilyloxy)-tetrahydro-2H-pyran-2-yl]methanol
- 740845-35-6
2-{[(2R,3R)-3-(tert-butyldimethylsilyloxy)-tetrahydro-2H-pyran-2-yl]methoxy}acetic acid
| Conditions | Yield |
|---|---|
| With sodium hydride In tetrahydrofuran at 0 - 20℃; | 94% |
| With sodium hydride In tetrahydrofuran | 94% |
- 305-53-3
monosodium iodoacetate
- 212205-68-0
(3R,4R)-4-Methoxymethoxy-hexadec-1-en-3-ol
- 212205-62-4
((1R,2R)-2-Methoxymethoxy-1-vinyl-tetradecyloxy)-acetic acid
| Conditions | Yield |
|---|---|
| With sodium hydride In tetrahydrofuran at 0 - 20℃; | 92% |
- 67-56-1
methanol
- 928-95-0
(E)-2-Hexen-1-ol
- 305-53-3
monosodium iodoacetate
- 256394-12-4
[((E)-Hex-2-enyl)oxy]-acetic acid methyl ester
| Conditions | Yield |
|---|---|
| Stage #1: (E)-2-Hexen-1-ol; monosodium iodoacetate With n-butyllithium In tetrahydrofuran at -78 - 20℃; Stage #2: methanol With dmap; dicyclohexyl-carbodiimide In dichloromethane at 0℃; for 0.5h; | 92% |
- 129964-91-6
(N,N'-bis(2-mercaptoethyl)-N,N'-diazacyclooctane)nickel(II)
- 305-53-3
monosodium iodoacetate
| Conditions | Yield |
|---|---|
| In methanol; acetonitrile addn. of ICH2CO2Na dissolved in CH3OH to a soln. of (C6H12N2)Ni(C2H4S)2 in CH3CN at 60°C under stirring; filtration of the soln. after 4 h, slow evapn. of the solvent, elem. anal.; | 90% |
- 305-53-3
monosodium iodoacetate
- 233670-03-6
2-Benzyloxybut-3-en-1-ol
- 257949-96-5
5-Benzyloxy-3-oxahept-6-enoic acid
| Conditions | Yield |
|---|---|
| Stage #1: 2-benzyloxy-3-buten-1-ol With n-butyllithium In tetrahydrofuran; hexane for 0.166667h; Metallation; Stage #2: monosodium iodoacetate In tetrahydrofuran; hexane for 2h; Alkylation; Heating; | 89% |
- 67-56-1
methanol
- 928-94-9
(Z)-2-hexen-1-ol
- 305-53-3
monosodium iodoacetate
- 301659-67-6
[((Z)-Hex-2-enyl)oxy]-acetic acid methyl ester
| Conditions | Yield |
|---|---|
| Stage #1: (Z)-2-hexen-1-ol; monosodium iodoacetate With n-butyllithium In tetrahydrofuran at -78 - 20℃; Stage #2: methanol With dmap; dicyclohexyl-carbodiimide In dichloromethane at 0℃; for 0.5h; | 87% |
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Chemistry
IUPAC Name: Sodium 2-iodoacetate
Synonyms: Sodium iodoacetate ; Acetic acid, 2-iodo-, sodium salt (1:1) ; Acetic acid, iodo-, sodium salt ; Iodoacetate, sodium salt ; Iodoacetic acid Sodium salt ; Sodium monoiodoacetate
Molecular Structure of Sodium monoiodoacetate (CAS NO:305-53-3) : 
Molecular Formula of Sodium monoiodoacetate (CAS NO:305-53-3) : C2H2IO2.Na
Molecular Weight of Sodium monoiodoacetate (CAS NO:305-53-3) : 207.93
CAS NO: 305-53-3
EINECS : 206-165-7
Mol File: 305-53-3.mol
Flash Point: 112.3 °C
Enthalpy of Vaporization: 55.03 kJ/mol
Boiling Point: 262.1 °C at 760 mmHg
Vapour Pressure: 0.00329 mmHg at 25°C
Melting point: 208 °C (dec.)(lit.)
Storage temp: -20°C
Solubility: methanol: 0.1 M at 20 °C, clear, colorless
Appearance:light yellow to yellow-brown powder
Uses
Sodium monoiodoacetate (CAS NO:305-53-3) is used in pharmaceutical industry.
Toxicity Data With Reference
| 1. | dni-hmn:lyms 10 mmol/L | STBIBN Studia Biophysica. 50 (1975),97. | ||
| 2. | ipr-rat LDLo:30 mg/kg | JPPMAB Journal of Pharmacy and Pharmacology. 17 (1965),814. | ||
| 3. | orl-mus LD50:63 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 86 (1946),336. | ||
| 4. | ipr-mus LD50:75 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) AD277-689 . |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Poison by ingestion and intraperitoneal routes. Experimental reproductive effects. Human mutation data reported. When heated to decomposition it emits toxic fumes of I− and Na2O.
Hazard Codes 
T,
Xn
Risk Statements 25-37/38-41-20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R37/38:Irritating to respiratory system and skin.
R25 :Toxic if swallowed.
R41:Risk of serious damage to the eyes.
Safety Statements 26-39-45-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S39:Wear eye / face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR UN 2811 6.1/PG 1
WGK Germany 3
RTECS AI3675000
F 3-8-10
HazardClass 6.1(b)
PackingGroup III
Specification
General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media: In case of fire, use water, dry chemical, chemical foam, or alcohol-resistant foam.