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91335-51-2

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Basic Information
CAS No.: 91335-51-2
Name: 2-BROMO-4,5-DIETHOXYBENZALDEHYDE
Article Data: 1
Molecular Structure:
Molecular Structure of 91335-51-2 (2-BROMO-4,5-DIETHOXYBENZALDEHYDE)
Formula: C11H13BrO3
Molecular Weight: 273.12
Synonyms: benzaldehyde, 2-bromo-4,5-diethoxy-
Density: 1.377 g/cm3
Boiling Point: 343.6 °C at 760 mmHg
Flash Point: 161.6 °C
PSA: 35.53000
LogP: 3.05900
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Specification

This chemical is called Benzaldehyde, 2-bromo-4,5-diethoxy-, and its systematic name is 2-bromo-4,5-diethoxybenzaldehyde. With the molecular formula of C11H13BrO3, its molecular weight is 273.12. The CAS registry number of this chemical is 91335-51-2.

Other characteristics of the Benzaldehyde, 2-bromo-4,5-diethoxy- can be summarised as followings: (1)ACD/LogP: 3.86; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 35.53 Å2; (7)Index of Refraction: 1.551; (8)Molar Refractivity: 63.31 cm3; (9)Molar Volume: 198.3 cm3; (10)Polarizability: 25.1×10-24cm3; (11)Surface Tension: 39 dyne/cm; (12)Density: 1.377 g/cm3; (13)Flash Point: 161.6 °C; (14)Enthalpy of Vaporization: 58.75 kJ/mol; (15)Boiling Point: 343.6 °C at 760 mmHg; (16)Vapour Pressure: 6.97E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=Cc1cc(OCC)c(OCC)cc1Br
2.InChI: InChI=1/C11H13BrO3/c1-3-14-10-5-8(7-13)9(12)6-11(10)15-4-2/h5-7H,3-4H2,1-2H
3.InChIKey: VUYKUJPMDHPGFA-UHFFFAOYAI