CAS No.81028-92-4,3-(3,5-Dichlorophenoxy)benzaldehyde Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	81028-92-4
Name:	3-(3,5-Dichlorophenoxy)benzaldehyde

Formula:	C₁₃H₈Cl₂O₂
Molecular Weight:	267.111
Synonyms:	3-(3,5-Dichlorophenoxybenzaldehyde;[3-(3,5-Dichlorophenoxy)phenyl]formaldehyde;m-(3,5-dichlorophenoxy)benzaldehyde;
EINECS:	279-661-4
Density:	1.365 g/cm³
Melting Point:	48-55 °C(lit.)
Boiling Point:	396.1 °C at 760 mmHg
Flash Point:	165.5 °C
Hazard Symbols:	Xn,N
Risk Codes:	22-41-43-50/53
Safety:	26-36/37/39-60-61
PSA:	26.30000
LogP:	4.59820

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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