Basic Information | Post buying leads | Suppliers |
Name |
Soman |
EINECS | N/A |
CAS No. | 96-64-0 | Density | 1.009g/cm3 |
PSA | 36.11000 | LogP | 3.23000 |
Solubility | N/A | Melting Point |
-41.9°C |
Formula | C7H16 F O2 P | Boiling Point | 201.2°Cat760mmHg |
Molecular Weight | 182.175 | Flash Point | 75.5°C |
Transport Information | N/A | Appearance | N/A |
Safety | A deadly experimental poison by inhalation, skin contact, subcutaneous, intravenous, intramuscular, and intraperitoneal routes. An extremely toxic military nerve gas. Mutation data reported. When heated to decomposition it emits very toxic fumes of F− and POx. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | Highly toxic by ingestion, inhalation, and skin absorption; may be fatal on short exposure; cholinesterase inhibitor; military nerve gas; fatal dose (man) 0.01 mg/kg. | |
Synonyms |
Phosphonofluoridicacid, methyl-, 1,2,2-trimethylpropyl ester (6CI,7CI,8CI,9CI); 1,2,2-Trimethylpropoxyfluorophosphineoxide; 1,2,2-Trimethylpropyl methylphosphonofluoridate; 3,3-Dimethyl-n-but-2-ylmethylphosphonofluoridate; GD; GD (chemical warfare agent); Methyl pinacolylphosphonofluoridate; Methyl pinacolyloxy phosphorylfluoride; Methylphosphonofluoridicacid 1,2,2-trimethylpropyl ester; PMFP; Phosphine oxide,fluoromethyl(1,2,2-trimethylpropoxy)-; Pinacoloxymethylphosphoryl fluoride;Pinacolyl methylfluorophosphonate; Pinacolyl methylphosphonofluoridate; Soman |
Molecule structure of Soman (CAS NO.96-64-0) :
IUPAC Name: 3-[fluoro(methyl)phosphoryl]oxy-2,2-dimethylbutane
Molecular Weight: 182.172904 g/mol
Molecular Formula: C7H16FO2P
Density: 1.009 g/cm3
Boiling Point: 201.2 °C at 760 mmHg
Flash Point: 75.5 °C
Index of Refraction: 1.394
Molar Refractivity: 43.18 cm3
Molar Volume: 180.4 cm3
Polarizability: 17.12×10-24 cm3
Surface Tension: 25.2 dyne/cm
Enthalpy of Vaporization: 41.96 kJ/mol
Vapour Pressure: 0.442 mmHg at 25 °C
XLogP3-AA: 2.1
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 182.087194
MonoIsotopic Mass: 182.087194
Topological Polar Surface Area: 26.3
Heavy Atom Count: 11
Complexity: 174
Canonical SMILES: CC(C(C)(C)C)OP(=O)(C)F
InChI: InChI=1S/C7H16FO2P/c1-6(7(2,3)4)10-11(5,8)9/h6H,1-5H3
InChIKey: GRXKLBBBQUKJJZ-UHFFFAOYSA-N
Soman was discovered by Richard Kuhn in Germany in 1944, and represented the last wartime nerve agent discovery (GF was not found until 1949). Soman was given the identifier GD post-war (GC was already in medical use) when the information relating to soman was recovered by the Soviet Union from its hiding place in a mine. The 3D crystal structure of soman complexed with acetylcholinesterase was determined by Millard et al. (1999) and can be seen at Proteopedia 1som.
Soman (CAS NO.96-64-0) can be thickened for use as a chemical spray using an acryloid copolymer. It can also be deployed as a binary chemical weapon; its precursor chemicals are methylphosphonyl difluoride and a mixture of pinacolyl alcohol and an amine.
1. | sce-ham:ovr 1100 µmol/L | MUREAV Mutation Research. 204 (1988),649. | ||
2. | ihl-hmn LCLo:70 mg/m3 | SCJUAD Science Journal. 4 (1967),33. | ||
3. | skn-hmn LDLo:18 mg/kg | SCJUAD Science Journal. 4 (1967),33. | ||
4. | ipr-rat LD50:98 µg/kg | PCBPBS Pesticide Biochemistry and Physiology. 26 (1986),202. | ||
5. | scu-rat LD50:75 µg/kg | FAATDF Fundamental and Applied Toxicology. 4 (2, Pt 2),(1984),S106. | ||
6. | ivn-rat LD50:44,500 ng/kg | NRTXDN Neurotoxicology. 4 (4)(1983),27. | ||
7. | ims-rat LD50:62 µg/kg | FAATDF Fundamental and Applied Toxicology. 5 (1985),S84. | ||
8. | ihl-mus LC50:1 mg/m3/30M | DEGEA3 Deutsche Gesundheitswesen. 15 (1960),2179. | ||
9. | skn-mus LD50:7800 µg/kg | TXAPA9 Toxicology and Applied Pharmacology. 5 (1963),685. | ||
10. | ipr-mus LD50:393 µg/kg | FAATDF Fundamental and Applied Toxicology. 4 (2, Pt 2),(1984),S96. | ||
11. | sku-mky LD50:13 |
A deadly experimental poison by inhalation, skin contact, subcutaneous, intravenous, intramuscular, and intraperitoneal routes. An extremely toxic military nerve gas. Mutation data reported. When heated to decomposition it emits very toxic fumes of F− and POx.
RIDADR :2810
HazardClass: 6.1(a)
PackingGroup: I
Soman (CAS NO.96-64-0) is also called 1,2,2-Trimethylpropyl methylphosphonofluoridate ; 1,2,2-Trimethylpropylester kyseliny methylfluorfosfonove ; 1-Methyl-2,2-dimethylpropylmethylphosphonofluoridate ; 2-Butanol, 3,3-dimethyl-, methylphosphonofluoridate ; 3,3-Dimethyl-2-butyl methylphosphonofluoridate ; 3,3-Dimethyl-n-but-2-yl methylphosphonofluoridate ; BRN 1928737 ; CCRIS 3417 ; EA 1210 ; GD ; HSDB 6764 ; Methyl pinacolyl phosphonofluoridate ; Methylphosphonofluoridic acid 1,2,2-trimethylpropyl ester ; Phosphonofluoridic acid, methyl-, 1,2,2-trimethylpropyl ester ; Pynacolyl methylfluorophosphonate ; T.2107 ; Zoman . Soman (CAS NO.96-64-0) is colorless liquid, odorless to fruity. It is hydrolyzed by water, rapidly hydrolyzed by dilute aqueous sodium hydroxide. Water alone removes Fluoride atom producing nontoxic acid. Acidic conditions produce hydrogen fluoride; alkaline conditions produce isopropyl alcohol and polymers. When heated to decomposition or reacted with steam, Soman emits very toxic fumes of fluorides and oxides of phosphorus. Slightly corrosive to steel. Health Hazard Median lethal dose (mg-min/m3): 2500 by skin (vapor) or 350 (liquid); 35 inhaled. Median incapacitating dose: 25 inhaled. Eye/skin toxicity: Very high. Rate of action: Very rapid. Physiological action: Cessation of breath-death may follow. Detoxification rate: Low, essentially cumulative. (ANSER)