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624-31-7

Basic Information
CAS No.: 624-31-7
Name: 4-Iodotoluene
Molecular Structure:
Molecular Structure of 624-31-7 (4-Iodotoluene)
Formula: C7H7I
Molecular Weight: 218.04
Synonyms: Toluene,p-iodo- (7CI,8CI);1-Iodo-4-methylbenzene;1-Methyl-4-iodobenzene;4-Iodomethylbenzene;
EINECS: 210-841-7
Density: 1.706 g/cm3
Melting Point: 33-36 °C
Boiling Point: 211.5 °C at 760 mmHg
Flash Point: 86.3 °C
Solubility: insoluble in water
Appearance: white to light yellow crystalline low melting mass
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 24/25-26
Transport Information:
PSA: 0.00000
LogP: 2.59960
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    Product name: 4-Iodotoluene CAS No.: 624-31-7 Molecule Formula:C7H7I Molecule Weight:218.03 Purity: 99.0% Package: 25kg/drum Description:Yellow crystalline powder Manufacture Standards:Enterprise Standard TESTING I

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    Product Name: 4-Iodotoluene Synonyms: 1-IODO-4-METHYLBENZENE;AURORA KA-7367;IODOTOLUENE(4-);4-Iodotouene;4-Iodotoluene,>98%;4-IODOTOLUENE;4-Iodotoluene 98%;4-IODOTOLUENE 99.5% CAS: 624-31-7 MF: C7H7I MW: 218.04 Mol File: 624-31-7

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Chemistry

IUPAC Name: 1-Iodo-4-methylbenzene
Synonyms of 4-Iodotoluene (CAS NO.624-31-7): 1-Methyl-4-iodobenzene ; p-Iodotoluene ; p-Methyliodobenzene ; p-Tolyl iodide
CAS NO: 624-31-7
Molecular Formula: C7H7I
Molecular Weight: 109.13
Molecular Structure:
EINECS: 210-841-7
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 0 Å2
Index of Refraction: 1.604
Molar Refractivity: 43.98 cm3
Molar Volume: 127.7 cm3
Surface Tension: 39.5 dyne/cm
Density: 1.706 g/cm3
Flash Point: 86.3 °C
Enthalpy of Vaporization: 42.95 kJ/mol
Boiling Point: 211.5 °C at 760 mmHg
Vapour Pressure: 0.264 mmHg at 25°C
Melting point: 33-36°C
Water solubility: insoluble
Sensitive: Light Sensitive
Appearance: white to light yellow crystalline
SMILES: Ic1ccc(cc1)C
InChI: InChI=1/C7H7I/c1-6-2-4-7(8)5-3-6/h2-5H,1H3
InChIKey: UDHAWRUAECEBHC-UHFFFAOYAY
Std. InChI: InChI=1S/C7H7I/c1-6-2-4-7(8)5-3-6/h2-5H,1H3
Std. InChIKey: UDHAWRUAECEBHC-UHFFFAOYSA-N
Product Categories of 4-Iodotoluene (CAS NO.624-31-7): Aromatic Hydrocarbons (substituted) & Derivatives;Halogen toluene;Iodine Compounds;Pharmaceutical Intermediate

Uses

 4-Iodotoluene (CAS NO.624-31-7) is mainly used for bio-pharmaceutical.

Safety Profile

The Hazard Codes: Xi
The Risk Statements information:
36/37/38:  Irritating to eyes, respiratory system and skin 
The Safety Statements information:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
24/25: Avoid contact with skin and eyes 
WGK Germany: 3
TSCA: T
Hazard Note: Irritant
Explodes when heated above 200°C. Upon decomposition it emits toxic fumes of I−. See also IODIDES.

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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media: In case of fire, use water, dry chemical, chemical foam, or alcohol-resistant foam. 
Handling: Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation.
Storage: Store in a cool, dry place. Keep container closed when not in use.