2-Hydroxy-3-iodocyclohepta-2,4,6-trien-1-one supplier

Name
2-hydroxy-3-iodocyclohepta-2,4,6-trien-1-one
EINECS
CAS No. 22704-53-6
Article Data5
CAS DataBase
Density 2.06 g/cm³
Solubility
Melting Point
Formula C₇H₅IO₂
Boiling Point 287 °C at 760mmHg
Molecular Weight 248.02
Flash Point 127.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Iodotropolone;NSC 98688;NSC 98912;
PSA
LogP

2-Hydroxy-3-iodocyclohepta-2,4,6-trien-1-one Specification

The 2-Hydroxy-3-iodocyclohepta-2,4,6-trien-1-one is an organic compound with the molecular formula C₇H₅IO₂. The CAS registry number of this chemical is 22704-53-6. It should be avoided direct sunshine. In addition, the price of this product changes with the market.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Index of Refraction: 1.695; (7)Molar Refractivity: 46.26 cm³; (8)Molar Volume: 120.2 cm³; (9)Polarizability: 18.34×10^-24 cm³; (10)Surface Tension: 59.5 dyne/cm; (11)Density: 2.06 g/cm3; (12)Flash Point: 127.4 °C; (13)Enthalpy of Vaporization: 61.05 kJ/mol; (14)Boiling Point: 287 °C at 760 mmHg; (15)Vapour Pressure: 0.000287 mmHg at 25°C; (16)Tautomer Count: 5; (17)Exact Mass: 247.933422; (18)MonoIsotopic Mass: 247.933422; (19)Topological Polar Surface Area: 37.3; (20)Heavy Atom Count: 10; (21)Complexity: 248.

People can use the following data to convert to the molecule structure.
1. SMILES: O=C1/C=C\C=CC(\I)=C1\O;
2. InChI: InChI=1/C7H5IO2/c8-5-3-1-2-4-6(9)7(5)10/h1-4H,(H,9,10);
3. InChIKey: UWKAJCHYWMIXII-UHFFFAOYAS.

Product Name

2-hydroxy-3-iodocyclohepta-2,4,6-trien-1-one

2-Hydroxy-3-iodocyclohepta-2,4,6-trien-1-one Specification

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