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Name |
(R)-2,6-Dimethyl-1,2,3,4-tetrahydroquinoline |
EINECS | N/A |
CAS No. | 161745-33-1 | Density | 0.957 g/cm3 |
PSA | 12.03000 | LogP | 2.87960 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H15N | Boiling Point | 271.324 °C at 760 mmHg |
Molecular Weight | 161.247 | Flash Point | 121.705 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(2R)-2,6-Dimethyl-1,2,3,4-tetrahydroquinoline; |
Article Data | 2 |
The (R)-2,6-Dimethyl-1,2,3,4-tetrahydroquinoline, with the CAS registry number 161745-33-1, is also known as Quinoline, 1,2,3,4-tetrahydro-2,6-dimethyl-, (2R)-. This chemical's molecular formula is C11H15N and molecular weight is 161.24. What's more, its systematic name is (2R)-2,6-Dimethyl-1,2,3,4-tetrahydroquinoline.
Physical properties of (R)-2,6-Dimethyl-1,2,3,4-tetrahydroquinoline are: (1)ACD/LogP: 3.242; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.80; (4)ACD/LogD (pH 7.4): 3.23; (5)ACD/BCF (pH 5.5): 62.09; (6)ACD/BCF (pH 7.4): 167.67; (7)ACD/KOC (pH 5.5): 500.85; (8)ACD/KOC (pH 7.4): 1352.56; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.03 Å2; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 51.308 cm3; (15)Molar Volume: 168.562 cm3; (16)Polarizability: 20.34×10-24cm3; (17)Surface Tension: 32.8 dyne/cm; (18)Density: 0.957 g/cm3; (19)Flash Point: 121.705 °C; (20)Enthalpy of Vaporization: 50.955 kJ/mol; (21)Boiling Point: 271.324 °C at 760 mmHg; (22)Vapour Pressure: 0.006 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc2c(c1)CC[C@H](N2)C
(2)Std. InChI: InChI=1S/C11H15N/c1-8-3-6-11-10(7-8)5-4-9(2)12-11/h3,6-7,9,12H,4-5H2,1-2H3/t9-/m1/s1
(3)Std. InChIKey: IHEQGRQCHGIUQE-SECBINFHSA-N