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170729-79-0

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Basic Information
CAS No.: 170729-79-0
Name: [2R-[2aR*),3a]-2-[1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine
Article Data: 6
Molecular Structure:
Molecular Structure of 170729-79-0 ([2R-[2aR*),3a]-2-[1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine)
Formula: C20H18F7NO2
Molecular Weight: 437.35
Synonyms: 2R-[2α(S*),3α]]-2-[1-[3,5-bis(trifluoromethyl)phenyl];[2R-[2aR*),3a]-2-[1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine;
Density: 1.37 g/cm3
Boiling Point: 387.9 °C at 760 mmHg
Flash Point: 188.4 °C
PSA: 30.49000
LogP: 5.95690
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Chemistry

Molecule structure of Morpholine,2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-, [2R-[2a(S*),3a]]- (9CI) (CAS NO.170729-79-0):

Molecular Weight: 437.35 g/mol
Molecular Formula: C20H18F7NO2
Density: 1.37 g/cm3 
Boiling Point: 387.9 °C at 760 mmHg 
Flash Point: 188.4 °C
Index of Refraction: 1.504
Molar Refractivity: 94.36 cm3
Molar Volume: 318.1 cm3
Polarizability: 37.4×10-24 cm3
Surface Tension: 36.5 dyne/cm 
Enthalpy of Vaporization: 63.7 kJ/mol
Vapour Pressure: 3.2E-06 mmHg at 25 °C 
InChI: InChI=1/C20H18F7NO2/c1-11(13-8-14(19(22,23)24)10-15(9-13)20(25,26)27)30-18-17(28-6-7-29-18)12-2-4-6(21)5-3-12/h2-5,8-11,17-18,28H,6-7H2,1H3/t11-,17-,18+/m0/s1 
InChIKey of Morpholine,2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-, [2R-[2a(S*),3a]]- (9CI) (CAS NO.170729-79-0): AFBDSAJOMZYQAI-FJNPEDAXBD

Specification

 Morpholine,2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-, [2R-[2a(S*),3a]]- (9CI) (CAS NO.170729-79-0) is also named as 2R-[2α(S*),3α]]-2-[1-[3,5-bis(trifluoromethyl)phenyl] ; [2R-[2aR*),3a]-2-[1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine ; [2R-[2α(S*),3α]]-2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)- Morpholine .