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Benzaldehyde, 4-(4-chlorophenoxy)-

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Name

Benzaldehyde, 4-(4-chlorophenoxy)-

EINECS N/A
CAS No. 61343-99-5 Density 1.266 g/cm3
PSA 26.30000 LogP 3.94480
Solubility N/A Melting Point 54-58 °C
Formula C13H9ClO2 Boiling Point 349.6 °C at 760 mmHg
Molecular Weight 232.666 Flash Point 146.8 °C
Transport Information UN 3077 Appearance crystalline
Safety 26-36/37-61 Risk Codes 22-36-43-51/53
Molecular Structure Molecular Structure of 61343-99-5 (4-(4-CHLOROPHENOXY)BENZALDEHYDE) Hazard Symbols HarmfulXn,DangerousN
Synonyms

4-(4-Chlorophenoxy)benzaldehyde;

Article Data 41

Benzaldehyde, 4-(4-chlorophenoxy)- Specification

This chemical is called Benzaldehyde, 4-(4-chlorophenoxy)-, and its systematic name is 4-(4-chlorophenoxy)benzaldehyde. With the molecular formula of C13H9ClO2, its product categories are Aldehydes; C10 to C21; Carbonyl Compounds. The CAS registry number of this chemical is 61343-99-5. In addition, this chemical should be sealed in the cool and dry place, away from oxides.

Other characteristics of the Benzaldehyde, 4-(4-chlorophenoxy)- can be summarised as followings: (1)ACD/LogP: 4.44; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.618; (8)Molar Refractivity: 64.34 cm3; (9)Molar Volume: 183.6 cm3; (10)Polarizability: 25.5×10-24cm3; (11)Surface Tension: 46.4 dyne/cm; (12)Density: 1.266 g/cm3; (13)Flash Point: 146.8 °C; (14)Enthalpy of Vaporization: 59.41 kJ/mol; (15)Boiling Point: 349.6 °C at 760 mmHg; (16)Vapour Pressure: 4.66E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is Harmful if swallowed and toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. It may cause sensitization by skin contacting. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. 

You can still convert the following datas into molecular structure:
1.SMILES: Clc2ccc(Oc1ccc(C=O)cc1)cc2
2.InChI: InChI=1/C13H9ClO2/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12/h1-9H
3.InChIKey: BLCXBCYVCDPFEU-UHFFFAOYAR

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