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263349-24-2

Basic Information
CAS No.: 263349-24-2
Name: 3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE
Molecular Structure:
Molecular Structure of 263349-24-2 (3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE)
Formula: C11H12BrNO2
Molecular Weight: 270.12
Synonyms: 3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE;3-Bromo-4-morpholinobenzaldehyde
Density: 1.495 g/cm3
Boiling Point: 406.8 ºC at 760 mmHg
Flash Point: 199.8 ºC
Hazard Symbols: IrritantXi
PSA: 29.54000
LogP: 2.16320
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  • 3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE  CAS NO.263349-24-2

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Specification

The CAS registry number of Benzaldehyde,3-bromo-4-(4-morpholinyl)- is 263349-24-2. This chemical's molecular formula is C11H12BrNO2 and molecular weight is 270.12. What's more, its systematic name is called 3-Bromo-4-(morpholin-4-yl)benzaldehyde. In addition, this chemical is irritanting and may cause inflammation to the skin or other mucous membranes.

Physical properties about Benzaldehyde,3-bromo-4-(4-morpholinyl)- are: (1)ACD/LogP: 2.56; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 22; (6)ACD/BCF (pH 7.4): 22; (7)ACD/KOC (pH 5.5): 320; (8)ACD/KOC (pH 7.4): 320; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.609; (14)Molar Refractivity: 62.506 cm3; (15)Molar Volume: 180.595 cm3; (16)Polarizability: 24.779×10-24 cm3; (17)Surface Tension: 49.613 dyne/cm; (18)Density: 1.496 g/cm3; (19)Flash Point: 199.836 °C; (20)Enthalpy of Vaporization: 65.861 kJ/mol; (21)Boiling Point: 406.817 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cc(Br)c(cc1)N2CCOCC2
(2) InChI: InChI=1/C11H12BrNO2/c12-10-7-9(8-14)1-2-11(10)13-3-5-15-6-4-13/h1-2,7-8H,3-6H2
(3) InChIKey: ARPSCKOKVZPRIN-UHFFFAOYAU