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

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Name

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

EINECS N/A
CAS No. 436087-00-2 Density 0.983 g/cm3
PSA 24.50000 LogP 3.12480
Solubility N/A Melting Point N/A
Formula C18H30N2O Boiling Point 403.1 °C at 760 mmHg
Molecular Weight 290.44 Flash Point 197.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 436087-00-2 ((4-TERT-BUTYL-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE) Hazard Symbols IrritantXi
Synonyms

ZINC02380326;

 

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

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