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Basic Information
CAS No.: 82625-45-4
Name: 4-(2-MORPHOLIN-4-YL-ETHOXY)-BENZALDEHYDE
Molecular Structure:
Molecular Structure of 82625-45-4 (4-(2-MORPHOLIN-4-YL-ETHOXY)-BENZALDEHYDE)
Formula: C13H17NO3
Molecular Weight: 235.283
Synonyms: Benzaldehyde,p-(2-morpholinoethoxy)- (7CI);4-(2-Morpholinoethoxy)benzaldehyde;4-[2-(4-Morpholinyl)ethoxy]benzaldehyde;4-(2-morpholin-4-ylethoxy)benzaldehyde;Benzaldehyde, 4-[2-(4-morpholinyl)ethoxy]-;
Density: 1.141 g/cm3
Boiling Point: 394.8 °C at 760 mmHg
Flash Point: 192.6 °C
Hazard Symbols: C,Xi
PSA: 38.77000
LogP: 1.14800
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Specification

The Benzaldehyde,4-[2-(4-morpholinyl)ethoxy]-, with the CAS registry number 82625-45-4, has the systematic name and IUPAC name of 4-(2-morpholin-4-ylethoxy)benzaldehyde. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C13H17NO3.

The characteristics of Benzaldehyde,4-[2-(4-morpholinyl)ethoxy]- are as followings: (1)ACD/LogP: 1.05; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 38.77 Å2; (7)Index of Refraction: 1.552; (8)Molar Refractivity: 65.94 cm3; (9)Molar Volume: 206.1 cm3; (10)Polarizability: 26.14×10-24cm3; (11)Surface Tension: 43.2 dyne/cm; (12)Density: 1.141 g/cm3; (13)Flash Point: 192.6 °C; (14)Enthalpy of Vaporization: 64.49 kJ/mol; (15)Boiling Point: 394.8 °C at 760 mmHg; (16)Vapour Pressure: 1.93E-06 mmHg at 25°C.   

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=Cc2ccc(OCCN1CCOCC1)cc2
(2)InChI: InChI=1/C13H17NO3/c15-11-12-1-3-13(4-2-12)17-10-7-14-5-8-16-9-6-14/h1-4,11H,5-10H2
(3)InChIKey: FGLXMUOMJOHGKH-UHFFFAOYAJ