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Basic Information
CAS No.: 86-15-7
Name: 4-(2,5-dibutoxy-4-nitrophenyl)morpholine
Molecular Structure:
Molecular Structure of 86-15-7 (4-(2,5-dibutoxy-4-nitrophenyl)morpholine)
Formula: C18H28N2O5
Molecular Weight: 352.431
Synonyms: 2,5-Dibutoxy-4-morpholinonitrobenzene;4-(2,5-Dibutoxy-4-nitrophenyl)morpholine;
EINECS: 201-652-0
Density: 1.13 g/cm3
Boiling Point: 514.8 °C at 760 mmHg
Flash Point: 265.1 °C
PSA: 76.75000
LogP: 4.37740
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Specification

The Morpholine,4-(2,5-dibutoxy-4-nitrophenyl)-, with CAS registry number 86-15-7, has the systematic name of 4-(2,5-dibutoxy-4-nitrophenyl)morpholine. Besides this, it is also called 4-Morpholino-2,5-dibutoxy-1-nitrobenzene. And the chemical formula of this chemical is C18H28N2O5. What's more, its EINECS is 201-652-0.

Physical properties of Morpholine,4-(2,5-dibutoxy-4-nitrophenyl)-: (1)ACD/LogP: 5.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.13; (4)ACD/LogD (pH 7.4): 5.13; (5)ACD/BCF (pH 5.5): 4681.77; (6)ACD/BCF (pH 7.4): 4682.07; (7)ACD/KOC (pH 5.5): 14752.49; (8)ACD/KOC (pH 7.4): 14753.39; (9)#H bond acceptors: 7; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 76.75 Å2; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 95.76 cm3; (15)Molar Volume: 311.6 cm3; (16)Polarizability: 37.96×10-24cm3; (17)Surface Tension: 42.5 dyne/cm; (18)Density: 1.13 g/cm3; (19)Flash Point: 265.1 °C; (20)Enthalpy of Vaporization: 78.65 kJ/mol; (21)Boiling Point: 514.8 °C at 760 mmHg; (22)Vapour Pressure: 1.05E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2cc(OCCCC)c(N1CCOCC1)cc2OCCCC
(2)InChI: InChI=1/C18H28N2O5/c1-3-5-9-24-17-14-16(20(21)22)18(25-10-6-4-2)13-15(17)19-7-11-23-12-8-19/h13-14H,3-12H2,1-2H3
(3)InChIKey: MKVBADWWJFSRRK-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C18H28N2O5/c1-3-5-9-24-17-14-16(20(21)22)18(25-10-6-4-2)13-15(17)19-7-11-23-12-8-19/h13-14H,3-12H2,1-2H3
(5)Std. InChIKey: MKVBADWWJFSRRK-UHFFFAOYSA-N