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Iodobenzene diacetate

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Iodobenzene diacetate

EINECS 221-808-1
CAS No. 3240-34-4 Density
Solubility insoluble in water Melting Point 161-163 °C(lit.)
Formula C10H11IO4 Boiling Point 456.8ºC at 760 mmHg
Molecular Weight 322.10 . Flash Point 230.1ºC
Transport Information UN 1479 Appearance white to light yellow crystal powder
Safety 22-24/25-37/39-26-36/37/39-27 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 3240-34-4 (Iodobenzene diacetate) Hazard Symbols IrritantXi
Synonyms

(Diacetoxyiodo)benzene;Iodosobenzene diacetate;PIA;

 

Iodobenzene diacetate Chemical Properties

Molecular Structure of Iodobenzene diacetate (CAS NO.3240-34-4):

IUPAC Name: [Acetyloxy(phenyl)-λ3-iodanyl] acetate
Canonical SMILES: CC(=O)OI(C1=CC=CC=C1)OC(=O)C
InChI: InChI=1S/C10H11IO4/c1-8(12)14-11(15-9(2)13)10-6-4-3-5-7-10/h3-7H,1-2H3
InChIKey: ZBIKORITPGTTGI-UHFFFAOYSA-N
Molecular Weight: 322.09641 [g/mol]
Molecular Formula: C10H11IO4
XLogP3-AA: 2.8
H-Bond Donor: 0
H-Bond Acceptor: 4 
EINECS: 221-808-1
Product Categories: Benzene derivatives; APIs; Hypervalent Iodine Compounds; Oxidation; Synthetic Organic Chemistry
Appearance: white to light yellow crystal powder
Melting Point: 161-163 °C(lit.)
Solubility: INSOLUBLE
Water Solubility: INSOLUBLE
Sensitive: Light Sensitive

Iodobenzene diacetate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02976,

Iodobenzene diacetate Consensus Reports

Reported in EPA TSCA Inventory.

Iodobenzene diacetate Safety Profile

Poison by intravenous route. When heated to decomposition it emits toxic fumes of I.
Safety Information of Iodobenzene diacetate (CAS NO.3240-34-4):
Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 22-24/25-37/39-26-36/37/39-27 
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes. 
S37/39:Wear suitable gloves and eye/face protection. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S27:Take off immediately all contaminated clothing.
RIDADR: 1479
WGK Germany: 3
RTECS: DA3525000
Hazard Note: Irritant
HazardClass: 6.1(b)
PackingGroup: III

Iodobenzene diacetate Specification

  Iodobenzene diacetate (CAS NO.3240-34-4), its Synonyms are (Diacetoxyiodo)benzene ; Benzene, (diacetoxyiodo)- ; Benzene, (dihydroxyiodo)-, diacetate ; Benzene, iodoso-, diacetate ; Bis(acetato)phenyliodine ; Phenyliodine diacetate ; Phenyliodine(III) diacetate ; Phenyliodo diacetate ; Phenyliodoso acetate ; Phenyliodoso diacetate ; Phenyliodosyl diacetate ; Iodine, bis(acetato-O)phenyl- (9CI) ; Iodine, bis(acetato-kappaO)phenyl- .

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