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Benzaldehyde,3-bromo-4-(4-morpholinyl)-

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Name

Benzaldehyde,3-bromo-4-(4-morpholinyl)-

EINECS N/A
CAS No. 263349-24-2 Density 1.495 g/cm3
PSA 29.54000 LogP 2.16320
Solubility N/A Melting Point N/A
Formula C11H12BrNO2 Boiling Point 406.8 ºC at 760 mmHg
Molecular Weight 270.12 Flash Point 199.8 ºC
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 263349-24-2 (3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE) Hazard Symbols IrritantXi
Synonyms

3-BROMO-4-(N-MORPHOLINO)BENZALDEHYDE;3-Bromo-4-morpholinobenzaldehyde

 

Benzaldehyde,3-bromo-4-(4-morpholinyl)- 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

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