Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester

Related Products

Hot Products

Name

1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester

EINECS N/A
CAS No. 118128-78-2 Density 1.099 g/cm3
PSA 38.33000 LogP 2.35940
Solubility N/A Melting Point N/A
Formula C12H15NO2 Boiling Point 358.3 °C at 760 mmHg
Molecular Weight 205.25 Flash Point 170.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 118128-78-2 (1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester) Hazard Symbols N/A
Synonyms

1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester;5-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-, ethyl ester;

Article Data 1

1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester Specification

This chemical is called 1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester, and its systematic name is 5-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-, ethyl ester. With the molecular formula of C12H15NO2, its molecular weight is 205.25. In addition, the CAS registry number of this chemical is 118128-78-2.

Other characteristics of the 1,2,3,4-Tetrahydroquinoline-5-carboxylic acid ethyl ester can be summarised as followings: (1)ACD/LogP: 3.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.13; (4)ACD/LogD (pH 7.4): 3.15; (5)ACD/BCF (pH 5.5): 137.88; (6)ACD/BCF (pH 7.4): 145.53; (7)ACD/KOC (pH 5.5): 1164.93; (8)ACD/KOC (pH 7.4): 1229.58; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 38.33 Å2; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 58.18 cm3; (15)Molar Volume: 186.6 cm3; (16) Polarizability: 23.06×10-24 cm3; (17)Surface Tension: 40.4 dyne/cm; (18)Density: 1.099 g/cm3; (19)Flash Point: 170.5 °C; (20)Enthalpy of Vaporization: 60.38 kJ/mol; (21)Boiling Point: 358.3 °C at 760 mmHg; (22)Vapour Pressure: 2.57E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: CCOC(=O)c1cccc2c1CCCN2
(2)InChI: InChI=1/C12H15NO2/c1-2-15-12(14)10-5-3-7-11-9(10)6-4-8-13-11/h3,5,7,13H,2,4,6,8H2,1H3
(3)InChIKey: IVUBOWZGLSRVFX-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C12H15NO2/c1-2-15-12(14)10-5-3-7-11-9(10)6-4-8-13-11/h3,5,7,13H,2,4,6,8H2,1H3
(5)Std. InChIKey: IVUBOWZGLSRVFX-UHFFFAOYSA-N 

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 118128-78-2