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| Name |
3-(3,5-Dichlorophenoxy)benzaldehyde |
EINECS | 279-661-4 |
| CAS No. | 81028-92-4 | Density | 1.365 g/cm3 |
| PSA | 26.30000 | LogP | 4.59820 |
| Solubility | N/A | Melting Point |
48-55 °C(lit.) |
| Formula | C13H8Cl2O2 | Boiling Point | 396.1 °C at 760 mmHg |
| Molecular Weight | 267.111 | Flash Point | 165.5 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 26-36/37/39-60-61 | Risk Codes | 22-41-43-50/53 |
| Molecular Structure |
|
Hazard Symbols | Xn,N |
| Synonyms |
3-(3,5-Dichlorophenoxybenzaldehyde;[3-(3,5-Dichlorophenoxy)phenyl]formaldehyde;m-(3,5-dichlorophenoxy)benzaldehyde; |
3-(3,5-Dichlorophenoxy)benzaldehyde Specification
The CAS register number of 3-(3,5-Dichlorophenoxy)benzaldehyde is 81028-92-4. It also can be called as m-(3,5-dichlorophenoxy)benzaldehyde and the IUPAC name about this chemical is 3-(3,5-dichlorophenoxy)benzaldehyde. The molecular formula about this chemical is C13H8Cl2O2 and molecular weight is 267.11. It belongs to the following product categories which include Aldehydes; C10 to C21; Carbonyl Compounds and so on.
Physical properties about 3-(3,5-Dichlorophenoxy)benzaldehyde are: (1)ACD/LogP: 4.83; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 26.3Å2; (5)Index of Refraction: 1.626; (6)Molar Refractivity: 69.23 cm3; (7)Molar Volume: 195.5 cm3; (8)Polarizability: 27.44x10-24cm3; (9)Surface Tension: 48.1 dyne/cm; (10)Flash Point: 165.5 °C; (11)Enthalpy of Vaporization: 64.64 kJ/mol; (12)Boiling Point: 396.1 °C at 760 mmHg; (13)Vapour Pressure: 1.75E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(Oc1cc(C=O)ccc1)cc(Cl)c2
(2)InChI: InChI=1/C13H8Cl2O2/c14-10-5-11(15)7-13(6-10)17-12-3-1-2-9(4-12)8-16/h1-8H
(3)InChIKey: BISWHYILBVQCRA-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C13H8Cl2O2/c14-10-5-11(15)7-13(6-10)17-12-3-1-2-9(4-12)8-16/h1-8H
(5)Std. InChIKey: BISWHYILBVQCRA-UHFFFAOYSA-N
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