Name: 4-(3-methoxy-4-nitrophenyl)morpholine
SKU: 6950-88-5

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Basic Information

Molecular Structure:
CAS No.:	6950-88-5
Name:	4-(3-methoxy-4-nitrophenyl)morpholine
Article Data:	21

Formula:	C₁₁H₁₄N₂O₄
Molecular Weight:	238.243
Synonyms:	4-(3-Methoxy-4-nitrophenyl)morpholine;NSC 65635;5-Morpholino-2-Nitroanisole;morpholine, 4-(3-methoxy-4-nitrophenyl)-;5-(4-Morpholino)-2-nitroanisole;
EINECS:	230-122-1
Density:	1.263 g/cm³
Melting Point:	165-168°
Boiling Point:	425.6 °C at 760 mmHg
Flash Point:	211.2 °C
PSA:	67.52000
LogP:	2.02820

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Specification

The 4-(3-Methoxy-4-nitrophenyl)morpholine with the cas number 6950-88-5 is also called morpholine, 4-(3-methoxy-4-nitrophenyl)-. Its EINECS registry number is 230-122-1. The molecular formula of this chemical is C₁₁H₁₄N₂O₄. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 1.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.57; (4)ACD/LogD (pH 7.4): 1.57; (5)ACD/BCF (pH 5.5): 9.26; (6)ACD/BCF (pH 7.4): 9.26; (7)ACD/KOC (pH 5.5): 171.25; (8)ACD/KOC (pH 7.4): 171.25; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 67.52 Å²; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 61.28 cm³; (15)Molar Volume: 188.5 cm³; (16)Polarizability: 24.29×10^-24cm³; (17)Surface Tension: 48.1 dyne/cm; (18)Enthalpy of Vaporization: 68.03 kJ/mol; (19)Vapour Pressure: 1.89×10^-7 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2c(OC)cc(N1CCOCC1)cc2
(2)InChI: InChI=1/C11H14N2O4/c1-16-11-8-9(2-3-10(11)13(14)15)12-4-6-17-7-5-12/h2-3,8H,4-7H2,1H3
(3)InChIKey: YMXOMWAFFGHJFC-UHFFFAOYAP