Ethanone,2-chloro-1-(3,4-dihydro-6-methoxy-2,2,4-trimethyl-1(2H)-quinolinyl)- supplier

Name
2-CHLORO-1-(6-METHOXY-2,2,4-TRIMETHYL-3,4-DIHYDRO-2H-QUINOLIN-1-YL)-ETHANONE
EINECS
CAS No. 376371-15-2
Density 1.116 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₀ClNO₂
Boiling Point 430.2 °C at 760 mmHg
Molecular Weight 281.7778
Flash Point 214 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Quinoline,1-(chloroacetyl)-1,2,3,4-tetrahydro-6-methoxy-2,2,4-trimethyl- (9CI);2-chloro-1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]ethanone;
PSA 29.54000
LogP 3.61780

Ethanone,2-chloro-1-(3,4-dihydro-6-methoxy-2,2,4-trimethyl-1(2H)-quinolinyl)- Specification

The Ethanone,2-chloro-1-(3,4-dihydro-6-methoxy-2,2,4-trimethyl-1(2H)-quinolinyl)-, with the CAS registry number 376371-15-2, has the systematic name of 2-chloro-1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]ethanone. And the molecular formula of the chemical is C₁₅H₂₀ClNO₂.

The characteristics of Ethanone,2-chloro-1-(3,4-dihydro-6-methoxy-2,2,4-trimethyl-1(2H)-quinolinyl)- are as followings: (1)ACD/LogP: 3.94; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 29.54 Å²; (7)Index of Refraction: 1.52; (8)Molar Refractivity: 76.75 cm³; (9)Molar Volume: 252.3 cm³; (10)Polarizability: 30.42×10^-24cm³; (11)Surface Tension: 35.5 dyne/cm; (12)Density: 1.116 g/cm³; (13)Flash Point: 214 °C; (14)Enthalpy of Vaporization: 68.57 kJ/mol; (15)Boiling Point: 430.2 °C at 760 mmHg; (16)Vapour Pressure: 1.32E-07 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: ClCC(=O)N2c1ccc(OC)cc1[C@H](CC2(C)C)C
(2)InChI: InChI=1/C15H20ClNO2/c1-10-8-15(2,3)17(14(18)9-16)13-6-5-11(19-4)7-12(10)13/h5-7,10H,8-9H2,1-4H3/t10-/m0/s1
(3)InChIKey: URNUWVIPNDXJGL-JTQLQIEIBG

Product Name

2-CHLORO-1-(6-METHOXY-2,2,4-TRIMETHYL-3,4-DIHYDRO-2H-QUINOLIN-1-YL)-ETHANONE

Ethanone,2-chloro-1-(3,4-dihydro-6-methoxy-2,2,4-trimethyl-1(2H)-quinolinyl)- Specification

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