Benzene,1-iodo-4-phenoxy- supplier

Name
4-IODODIPHENYL ETHER
EINECS
CAS No. 2974-94-9
Article Data23
CAS DataBase
Density 1.626 g/cm³
Solubility
Melting Point 43～45℃
Formula C₁₂H₉IO
Boiling Point 317.6 °C at 760 mmHg
Molecular Weight 296.107
Flash Point 145.9 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols Xi
Synonyms Ether,p-iodophenyl phenyl (6CI,7CI,8CI);1-Iodo-4-phenoxybenzene;4-Iododiphenylether;4-Iodophenyl phenyl ether;4-Phenoxyiodobenzene;Phenyl iodophenylether;p-Phenoxyiodobenzene;
PSA 9.23000
LogP 4.08350

Benzene,1-iodo-4-phenoxy- Specification

The Benzene,1-iodo-4-phenoxy- is an organic compound with the formula C₁₂H₉IO. The IUPAC name of this chemical is 1-iodo-4-phenoxybenzene. With the CAS registry number 2974-94-9, it is also named as 4-Iodophenyl phenyl ether. The product's category is API Intermediates.

Physical properties about Benzene,1-iodo-4-phenoxy- are: (1)ACD/LogP: 5.48; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.48; (4)ACD/LogD (pH 7.4): 5.48; (5)ACD/BCF (pH 5.5): 8571.6; (6)ACD/BCF (pH 7.4): 8571.6; (7)ACD/KOC (pH 5.5): 22744.47; (8)ACD/KOC (pH 7.4): 22744.47; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23 Å²; (12)Index of Refraction: 1.639; (13)Molar Refractivity: 65.6 cm³; (14)Molar Volume: 182 cm³; (15)Polarizability: 26×10^-24cm³; (16)Surface Tension: 45.9 dyne/cm; (17)Density: 1.626 g/cm³; (18)Flash Point: 145.9 °C; (19)Enthalpy of Vaporization: 53.67 kJ/mol; (20)Boiling Point: 317.6 °C at 760 mmHg; (21)Vapour Pressure: 0.00071 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic2ccc(Oc1ccccc1)cc2
(2)InChI: InChI=1/C12H9IO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
(3)InChIKey: BDKOUDYNKRCDEC-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C12H9IO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
(5)Std. InChIKey: BDKOUDYNKRCDEC-UHFFFAOYSA-N

Product Name

4-IODODIPHENYL ETHER

Benzene,1-iodo-4-phenoxy- Specification

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