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(S)-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid

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Name

(S)-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid

EINECS N/A
CAS No. 92976-98-2 Density 1.225 g/cm3
PSA 49.33000 LogP 1.63590
Solubility N/A Melting Point N/A
Formula C10H11NO2 Boiling Point 392.6 °C at 760 mmHg
Molecular Weight 177.203 Flash Point 191.2 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 92976-98-2 ((S)-1,2,3,4-TETRAHYDRO-QUINOLINE-2-CARBOXYLIC ACID) Hazard Symbols N/A
Synonyms

L-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid;

Article Data 3

(S)-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid Specification

The 2-Quinolinecarboxylicacid, 1,2,3,4-tetrahydro-, (2S)-, with its CAS registry number 92976-98-2, has other name of L-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid. And this chemical has its molecular formula of C10H11NO2 and molecular weight of 177.2. Besides, it should be kept in the cool and dry place. This chemical is irritating to eyes, respiratory system and skin, and you should wear suitable protective clothing, gloves and eye/face protection. And if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Physical properties of 2-Quinolinecarboxylicacid, 1,2,3,4-tetrahydro-, (2S)-: (1)ACD/LogP: 1.21; (2)# of Rule of 5 Violations: 0   ; (3)ACD/BCF (pH 5.5): 1 ; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1.13; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 49.33 Å2; (11)Index of Refraction: 1.576; (12)Molar Refractivity: 47.88 cm3; (13)Molar Volume: 144.5 cm3; (14)Polarizability: 18.98×10-24cm3; (15)Surface Tension: 48.2 dyne/cm; (16)Density: 1.225 g/cm3; (17)Flash Point: 191.2 °C; (18)Enthalpy of Vaporization: 67.75 kJ/mol; (19)Boiling Point: 392.6 °C at 760 mmHg; (20)Vapour Pressure: 7.22E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:OC(=O)[C@@H]1CCc2ccccc2N1
(2)Std. InChI:InChI=1S/C10H11NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-4,9,11H,5-6H2,(H,12,13)/t9-/m0/s1
(3)Std. InChIKey:OSJVTYVKQNOXPP-VIFPVBQESA-N

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