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1-Iodo-4-(methoxymethyl)benzene

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Name

1-Iodo-4-(methoxymethyl)benzene

EINECS N/A
CAS No. 91912-54-8 Density 1.646 g/cm3
PSA 9.23000 LogP 2.43760
Solubility N/A Melting Point N/A
Formula C8H9IO Boiling Point 222.4 °C at 760 mmHg
Molecular Weight 248.063 Flash Point 88.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 91912-54-8 (1-Iodo-4-(methoxymethyl)benzene) Hazard Symbols N/A
Synonyms

Ether,p-iodobenzyl methyl (7CI);1-Iodo-4-(methoxymethyl)benzene;4-(Methoxymethyl)iodobenzene;

 

1-Iodo-4-(methoxymethyl)benzene Specification

The 1-Iodo-4-(methoxymethyl)benzene with the CAS number 91912-54-8 is also called Benzene,1-iodo-4-(methoxymethyl)-. Its molecular formula is C8H9IO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 1-Iodo-4-(methoxymethyl)benzene are: (1)ACD/LogP: 2.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.99; (4)ACD/LogD (pH 7.4): 2.99 ; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: Å2; (9)Index of Refraction: 1.584; (10)Molar Refractivity: 50.45 cm3; (11)Molar Volume: 150.6 cm3; (12)Polarizability: 20×10-24cm3; (13)Surface Tension: 40 dyne/cm; (14)Enthalpy of Vaporization: 44.02 kJ/mol; (15)Vapour Pressure: 0.152 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COCc1ccc(cc1)I
(2)InChI: InChI=1/C8H9IO/c1-10-6-7-2-4-8(9)5-3-7/h2-5H,6H2,1H3
(3)InChIKey: DCQYAEJVEBYSTJ-UHFFFAOYAD

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