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Benzaldehyde,4-[(2,4-dichlorophenyl)methoxy]-

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Name

Benzaldehyde,4-[(2,4-dichlorophenyl)methoxy]-

EINECS N/A
CAS No. 70627-17-7 Density 1.34 g/cm3
PSA 26.30000 LogP 4.38490
Solubility N/A Melting Point 102-104°C
Formula C14H10Cl2O2 Boiling Point 419.8 °C at 760 mmHg
Molecular Weight 281.138 Flash Point 173.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 70627-17-7 (4-[(2,4-DICHLOROBENZYL)OXY]BENZALDEHYDE) Hazard Symbols IrritantXi
Synonyms

4-(2,4-Dichlorobenzyloxy)benzaldehyde;

Article Data 9

Benzaldehyde,4-[(2,4-dichlorophenyl)methoxy]- Specification

The Benzaldehyde,4-[(2,4-dichlorophenyl)methoxy]-, with CAS registry number 70627-17-7, has the systematic name of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde. Besides this, it is also called TIMTEC-BB SBB002111. And the chemical formula of this chemical is C14H10Cl2O2.

Physical properties of Benzaldehyde,4-[(2,4-dichlorophenyl)methoxy]-: (1)ACD/LogP: 4.56; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.623; (8)Molar Refractivity: 73.96 cm3; (9)Molar Volume: 209.7 cm3; (10)Polarizability: 29.32×10-24cm3; (11)Surface Tension: 48.3 dyne/cm; (12)Density: 1.34 g/cm3; (13)Flash Point: 173.2 °C; (14)Enthalpy of Vaporization: 67.36 kJ/mol; (15)Boiling Point: 419.8 °C at 760 mmHg; (16)Vapour Pressure: 2.95E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)ccc1COc2ccc(C=O)cc2
(2)InChI: InChI=1/C14H10Cl2O2/c15-12-4-3-11(14(16)7-12)9-18-13-5-1-10(8-17)2-6-13/h1-8H,9H2
(3)InChIKey: MCFMTPMHCQCPNT-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C14H10Cl2O2/c15-12-4-3-11(14(16)7-12)9-18-13-5-1-10(8-17)2-6-13/h1-8H,9H2
(5)Std. InChIKey: MCFMTPMHCQCPNT-UHFFFAOYSA-N

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