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CAS No.: | 147241-85-8 |
---|---|
Name: | N,N-dimethyl-2-[2-methyl-4-[3-(trifluoromethyl)phenyl]chroman-7-yl]oxy -ethanamine |
Molecular Structure: | |
Formula: | C21H24 F3 N O2 |
Molecular Weight: | 379.46 |
Synonyms: | N,N-dimethyl-2-[2-methyl-4-[3-(trifluoromethyl)phenyl]chroman-7-yl]oxy -ethanamine |
Density: | 1.164g/cm3 |
Boiling Point: | 417.9°Cat760mmHg |
Flash Point: | 206.6°C |
Safety: | Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx and F−. |
PSA: | 21.70000 |
LogP: | 4.94870 |
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Molecule structure of Ethanamine, 2-((3,4-dihydro-2-methyl-4-(3-(trifluoromethyl)phenyl)-2H-1-benzopyran-7-yl)oxy)-N,N-dimethyl- (CAS NO.147241-85-8) :
IUPAC Name: N,N-dimethyl-2-[[2-methyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-7-yl]oxy]ethanamine
Molecular Weight: 379.41597 g/mol
Molecular Formula: C21H24F3NO2
Density: 1.164 g/cm3
Boiling Point: 417.9 °C at 760 mmHg
Flash Point: 206.6 °C
Index of Refraction: 1.516
Molar Refractivity: 98.46 cm3
Molar Volume: 325.7 cm3
Polarizability: 39.03*10-24 cm3
Surface Tension: 34.5 dyne/cm
Enthalpy of Vaporization: 67.14 kJ/mol
Vapour Pressure: 3.41E-07 mmHg at 25 °C
XLogP3-AA: 5.1
H-Bond Acceptor: 6
Rotatable Bond Count: 5
Exact Mass: 379.175914
MonoIsotopic Mass: 379.175914
Topological Polar Surface Area: 21.7
Heavy Atom Count: 27
Complexity: 471
Canonical SMILES: CC1CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F
InChI: InChI=1S/C21H24F3NO2/c1-14-11-19(15-5-4-6-16(12-15)21(22,23)24)18-8-7-17(13-20(18)27-14)26-10-9-25(2)3/h4-8,12-14,19H,9-11H2,1-3H3
InChIKey of Ethanamine, 2-((3,4-dihydro-2-methyl-4-(3-(trifluoromethyl)phenyl)-2H-1-benzopyran-7-yl)oxy)-N,N-dimethyl- (CAS NO.147241-85-8) : GKQQWVNUPNIGPZ-UHFFFAOYSA-N
Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx and F−.
Ethanamine, 2-((3,4-dihydro-2-methyl-4-(3-(trifluoromethyl)phenyl)-2H-1-benzopyran-7-yl)oxy)-N,N-dimethyl- (CAS NO.147241-85-8) is also called 2-((3,4-Dihydro-2-methyl-4-(3-(trifluoromethyl)phenyl)-2H-1-benzopyran-7-yl)oxy)-N,N-dimethylethanamine .