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Basic Information
CAS No.: 436087-00-2
Name: (4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE
Molecular Structure:
Molecular Structure of 436087-00-2 ((4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE)
Formula: C18H30N2O
Molecular Weight: 290.44
Synonyms: ZINC02380326;
Density: 0.983 g/cm3
Boiling Point: 403.1 °C at 760 mmHg
Flash Point: 197.6 °C
Hazard Symbols: IrritantXi
PSA: 24.50000
LogP: 3.12480
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  • (4-tert-butylphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium

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    (4-tert-butylphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium

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  • 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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    4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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  • 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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    4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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  • (4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

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    (4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

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  • 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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  • 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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    436087-00-2

    4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-

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  • (4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

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    436087-00-2

    (4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

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Specification

The 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-, with the CAS registry number 436087-00-2, is also known as ZINC02380326. This chemical's molecular formula is C18H30N2O and molecular weight is 290.4436. Its IUPAC name is called (4-tert-butylphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes. 

Physical properties of 4-Morpholinepropanamine,N-[[4-(1,1-dimethylethyl)phenyl]methyl]-: (1)ACD/LogP: 3.19; (2)ACD/LogD (pH 5.5): -0.82; (3)ACD/LogD (pH 7.4): 0.87; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 6.17; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 7; (11)Index of Refraction: 1.512; (12)Molar Refractivity: 88.68 cm3; (13)Molar Volume: 295.3 cm3; (14)Surface Tension: 36.1 dyne/cm; (15)Density: 0.983 g/cm3; (16)Flash Point: 197.6 °C; (17)Enthalpy of Vaporization: 65.44 kJ/mol; (18)Boiling Point: 403.1 °C at 760 mmHg; (19)Vapour Pressure: 1.04E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O2CCN(CCCNCc1ccc(cc1)C(C)(C)C)CC2
(2)InChI: InChI=1/C18H30N2O/c1-18(2,3)17-7-5-16(6-8-17)15-19-9-4-10-20-11-13-21-14-12-20/h5-8,19H,4,9-15H2,1-3H3
(3)InChIKey: QHOWYYMIZRKELF-UHFFFAOYAY