Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2,4,5-Trimethoxyphenethylamine |
EINECS | N/A |
CAS No. | 15394-83-9 | Density | 1.067 g/cm3 |
PSA | 53.71000 | LogP | 1.91390 |
Solubility | N/A | Melting Point |
66-68 °C |
Formula | C11H17NO3 | Boiling Point | 320.48 °C at 760 mmHg |
Molecular Weight | 211.261 | Flash Point | 152.727 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Phenethylamine,2,4,5-trimethoxy- (8CI);2,4,5-Trimethoxy-b-phenethylamine;UNII-S27QYQ708U;2-(2,4,5-Trimethoxyphenyl)ethanamine; |
Article Data | 3 |
The Benzeneethanamine,2,4,5-trimethoxy-, with the CAS registry number 15394-83-9, is also known as Phenethylamine,2,4,5-trimethoxy- (8CI). This chemical's molecular formula is C11H17NO3 and molecular weight is 211.12. What's more, its systematic name is 2-(2,4,5-Trimethoxyphenyl)ethanamine.
Physical properties of Benzeneethanamine,2,4,5-trimethoxy- are: (1)ACD/LogP: 0.881; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.17; (4)ACD/LogD (pH 7.4): -1.18; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 53.71 Å2; (13)Index of Refraction: 1.511; (14)Molar Refractivity: 59.373 cm3; (15)Molar Volume: 197.935 cm3; (16)Polarizability: 23.537×10-24cm3; (17)Surface Tension: 35.43 dyne/cm; (18)Density: 1.067 g/cm3; (19)Flash Point: 152.727 °C; (20)Enthalpy of Vaporization: 56.216 kJ/mol; (21)Boiling Point: 320.48 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(c(OC)cc1OC)CCN)C
(2)Std. InChI: InChI=1S/C11H17NO3/c1-13-9-7-11(15-3)10(14-2)6-8(9)4-5-12/h6-7H,4-5,12H2,1-3H3
(3)Std. InChIKey: GKATTZLSNLYADI-UHFFFAOYSA-N