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4-(4-Nitrophenyl)morpholin-3-one

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Name

4-(4-Nitrophenyl)morpholin-3-one

EINECS 610-199-1
CAS No. 446292-04-2 Density 1.379 g/cm3
PSA 75.36000 LogP 1.54620
Solubility N/A Melting Point N/A
Formula C10H10N2O4 Boiling Point 516.802 °C at 760 mmHg
Molecular Weight 222.2 Flash Point 266.352 °C
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 446292-04-2 (4-(4-nitrophenyl)morpholin-3-one) Hazard Symbols N/A
Synonyms

4-(4-NITROPHENYL)MORPHOLIN-3-ONE

Article Data 34

4-(4-Nitrophenyl)morpholin-3-one Specification

The 4-(4-Nitrophenyl)morpholin-3-one, with CAS registry number of 446292-04-2,  is also known as 3-Morpholinone, 4-(4-nitrophenyl)-; 4-(4-Nitrophenyl)-3-Morpholinone; 4-(3-Oxo-4-morpholinyl)nitrobenzene; 4-(4-Nitrophenyl)-3-oxomorpholine. The IUPAC name is 4-(4-Nitrophenyl)morpholin-3-one. In addition, the formula is C10H10N2O4 and the molecular weight is 222.20.

Physical properties about 4-(4-Nitrophenyl)morpholin-3-one are: (1)ACD/LogP: 0.882; (2)ACD/LogD (pH 5.5): 0.88; (3)ACD/LogD (pH 7.4): 0.88; (4)ACD/BCF (pH 5.5): 2.76; (5)ACD/BCF (pH 7.4): 2.76; (6)ACD/KOC (pH 5.5): 71.92; (7)ACD/KOC (pH 7.4): 71.92; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.595; (11)Molar Refractivity: 54.739 cm3; (12)Molar Volume: 161.084 cm3; (13)Polarizability: 21.7 10-24cm3; (14)Surface Tension: 57.3530006408691 dyne/cm; (15)Density: 1.379 g/cm3; (16)Flash Point: 266.352 °C; (17)Enthalpy of Vaporization: 78.897 kJ/mol; (18)Boiling Point: 516.802 °C at 760 mmHg

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c2ccc(N1C(=O)COCC1)cc2
(2) InChI: InChI=1/C10H10N2O4/c13-10-7-16-6-5-11(10)8-1-3-9(4-2-8)12(14)15/h1-4H,5-7H2
(3) InChIKey: OWMGEFWSGOTGAU-UHFFFAOYAD

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