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200064-11-5

Basic Information
CAS No.: 200064-11-5
Name: 4-(5-BROMOPYRIDIN-2-YL)MORPHOLINE
Article Data: 25
Molecular Structure:
Molecular Structure of 200064-11-5 (4-(5-BROMOPYRIDIN-2-YL)MORPHOLINE)
Formula: C9H11BrN2O
Molecular Weight: 243.103
Synonyms: 2-(4-Morpholinyl)-5-bromopyridine;3-Bromo-5-morpholinopyridine;
Density: 1.499 g/cm3
Boiling Point: 354.545 °C at 760 mmHg
Flash Point: 168.223 °C
Hazard Symbols: T
Risk Codes: 25
Safety: 45
PSA: 25.36000
LogP: 1.74570
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  • Morpholine,4-(5-bromo-2-pyridinyl)-

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Specification

The 4-(5-Bromopyridin-2-yl)morpholine is an organic compound with the formula C9H11BrN2O. The IUPAC name of this chemical is 4-(5-bromopyridin-2-yl)morpholine. With the CAS registry number 200064-11-5, it is also named as Morpholine, 4-(5-bromo-2-pyridinyl)-. The product's categories are Pharmacetical; Pyridine Series; Halides; Pyridines; Organohalides; Pyridine.

Physical properties about 4-(5-Bromopyridin-2-yl)morpholine are: (1)ACD/LogP: 2.55; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 51; (5)ACD/BCF (pH 7.4): 51; (6)ACD/KOC (pH 5.5): 578; (7)ACD/KOC (pH 7.4): 582; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 25.36 Å2; (11)Index of Refraction: 1.578; (12)Molar Refractivity: 53.844 cm3; (13)Molar Volume: 162.153 cm3; (14)Polarizability: 21.346×10-24cm3; (15)Surface Tension: 48.387 dyne/cm; (16)Density: 1.499 g/cm3; (17)Flash Point: 168.223 °C; (18)Enthalpy of Vaporization: 59.959 kJ/mol; (19)Boiling Point: 354.545 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ncc1Br)N2CCOCC2
(2)InChI: InChI=1/C9H11BrN2O/c10-8-1-2-9(11-7-8)12-3-5-13-6-4-12/h1-2,7H,3-6H2
(3)InChIKey: NKJIYYDCYKUWNB-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C9H11BrN2O/c10-8-1-2-9(11-7-8)12-3-5-13-6-4-12/h1-2,7H,3-6H2
(5)Std. InChIKey: NKJIYYDCYKUWNB-UHFFFAOYSA-N