CAS No.31466-44-1,2-MORPHOLIN-4-YL-2-PHENYLETHYLAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	31466-44-1
Name:	2-MORPHOLIN-4-YL-2-PHENYLETHYLAMINE

Formula:	C₁₂H₁₈N₂O
Molecular Weight:	206.28
Synonyms:	Morpholine,4-[a-(aminomethyl)benzyl]- (8CI);[2-(Morpholin-4-yl)-2-phenylethyl]amine;2-morpholin-4-yl-2-phenylethanamine;2-(Morpholin-4-yl)-2-phenylethanamine;4-Morpholineethanamine, β-phenyl-;
Density:	1.098 g/cm³
Boiling Point:	313.8 °C at 760 mmHg
Flash Point:	143.6 °C
Hazard Symbols:	Xi
PSA:	38.49000
LogP:	1.65680

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Specification

The 4-Morpholineethanamine,β-phenyl-, with the CAS registry number 31466-44-1, has the systematic name and IUPAC name of 2-morpholin-4-yl-2-phenylethanamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₂H₁₈N₂O.

The characteristics of 4-Morpholineethanamine,β-phenyl- are as followings: (1)ACD/LogP: 0.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.48; (4)ACD/LogD (pH 7.4): -0.98; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.45; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 15.71 Å²; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 60.95 cm³; (15)Molar Volume: 187.7 cm³; (16)Polarizability: 24.16×10^-24cm³; (17)Surface Tension: 45.9 dyne/cm; (18)Density: 1.098 g/cm³; (19)Flash Point: 143.6 °C; (20)Enthalpy of Vaporization: 55.49 kJ/mol; (21)Boiling Point: 313.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000485 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O2CCN(C(c1ccccc1)CN)CC2
(2)InChI: InChI=1/C12H18N2O/c13-10-12(11-4-2-1-3-5-11)14-6-8-15-9-7-14/h1-5,12H,6-10,13H2
(3)InChIKey: WSNSRJWLIVDXDI-UHFFFAOYAB