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CAS No.: | 699016-40-5 |
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Name: | 2-FLUORO-4-IODOBENZALDEHYDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C7H4FIO |
Molecular Weight: | 250.011 |
Synonyms: | 2-Fluoro-4-iodobenzaldehyde;4-Iodo-2-fluorobenzaldehyde; |
Density: | 1.962 g/cm3 |
Boiling Point: | 259.9 °C at 760 mmHg |
Flash Point: | 111 °C |
PSA: | 17.07000 |
LogP: | 2.24280 |
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The CAS register number of Benzaldehyde,2-fluoro-4-iodo- is 699016-40-5. It also can be called as 4-Iodo-2-fluorobenzaldehyde and the systematic name about this chemical is 2-fluoro-4-iodobenzaldehyde. The molecular formula about this chemical is C7H4FIO and the molecular weight is 250.0089. It belongs to the following product categories which include Adehydes, Acetals & Ketones; Fluorine Compounds; Iodine Compounds and so on.
Physical properties about Benzaldehyde,2-fluoro-4-iodo- are: (1)ACD/LogP: 2.98; (2)ACD/LogD (pH 5.5): 2.98; (3)ACD/LogD (pH 7.4): 2.98; (4)ACD/BCF (pH 5.5): 109.18; (5)ACD/BCF (pH 7.4): 109.18; (6)ACD/KOC (pH 5.5): 1001.17; (7)ACD/KOC (pH 7.4): 1001.17; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 17.07Å2; (11)Index of Refraction: 1.64; (12)Molar Refractivity: 45.9 cm3; (13)Molar Volume: 127.3 cm3; (14)Polarizability: 18.19x10-24cm3; (15)Surface Tension: 47.8 dyne/cm; (16)Enthalpy of Vaporization: 49.76 kJ/mol; (17)Boiling Point: 259.9 °C at 760 mmHg; (18)Vapour Pressure: 0.0126 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c(F)cc(I)cc1
(2)InChI: InChI=1/C7H4FIO/c8-7-3-6(9)2-1-5(7)4-10/h1-4H
(3)InChIKey: LMDKAOXRCQPCAW-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C7H4FIO/c8-7-3-6(9)2-1-5(7)4-10/h1-4H
(5)Std. InChIKey: LMDKAOXRCQPCAW-UHFFFAOYSA-N