CAS No.63492-82-0,(S)-1,2,3,4-TETRAHYDRO-QUINOLINE-2-CARBOXYLIC ACID METHYL ESTER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	63492-82-0
Name:	(S)-1,2,3,4-TETRAHYDRO-QUINOLINE-2-CARBOXYLIC ACID METHYL ESTER
Article Data:	12

Formula:	C₁₁H₁₃NO₂
Molecular Weight:	191.23
Synonyms:	2-Quinolinecarboxylicacid, 1,2,3,4-tetrahydro-, methyl ester, (S)-;
Density:	1.125 g/cm³
Boiling Point:	315 °C at 760 mmHg
Flash Point:	144.3 °C
Hazard Symbols:	T
Risk Codes:	25
Safety:	45
PSA:	38.33000
LogP:	1.72430

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Specification

The 2-Quinolinecarboxylicacid, 1, 2, 3, 4-tetrahydro-, methyl ester, (2S)-, with the CAS registry number 63492-82-0, is also known as (S)-1, 2, 3, 4-Tetrahydro-quinoline-2-carboxylic acid methyl ester. This chemical's molecular formula is C₁₁H₁₃NO₂ and molecular weight is 191.23. What's more, its systematic name is Methyl (2S)-1, 2, 3, 4-tetrahydroquinoline-2-carboxylate.

Physical properties about 2-Quinolinecarboxylicacid, 1, 2, 3, 4-tetrahydro-, methyl ester, (2S)- are: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 29.54 Å²; (7)Index of Refraction: 1.532; (8)Molar Refractivity: 52.72 cm³; (9)Molar Volume: 169.9 cm³; (10)Polarizability: 20.9×10^-24 cm³; (11)Surface Tension: 38.9 dyne/cm; (12)Density: 1.125 g/cm³; (13)Flash Point: 144.3 °C; (14)Enthalpy of Vaporization: 55.62 kJ/mol; (15)Boiling Point: 315 °C at 760 mmHg; (16)Vapour Pressure: 0.000449 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC)[C@H]2Nc1ccccc1CC2
(2) InChI: InChI=1/C11H13NO2/c1-14-11(13)10-7-6-8-4-2-3-5-9(8)12-10/h2-5,10,12H,6-7H2,1H3/t10-/m0/s1
(3) InChIKey: ACEPYLDNGYGKDY-JTQLQIEIBC