3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline supplier

Name
3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline
EINECS 226-556-6
CAS No. 5423-67-6
Article Data7
CAS DataBase
Density 1.219g/cm³
Solubility
Melting Point 148-150 °C
Formula C₁₃H₁₃NO
Boiling Point 424.3°C at 760mmHg
Molecular Weight 199.252
Flash Point 210.5°C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,2,3,4-Tetrahydrobenzo[h]quinolin-3-ol;3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline;NSC 13233;
PSA 32.26000
LogP 2.30670

3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline Specification

The 3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline with the CAS number 5423-67-6 is also called Benzo[h]quinolin-3-ol,1,2,3,4-tetrahydro-. Both the systematic name and IUPAC name are 1,2,3,4-tetrahydrobenzo[h]quinolin-3-ol. Its EINECS registry number is 226-556-6. The molecular formula is C₁₃H₁₃NO. The product's category is pharmacetical.

The properties of the chemical are: (1)ACD/LogP: 1.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.9; (4)ACD/LogD (pH 7.4): 1.97; (5)ACD/BCF (pH 5.5): 15.6; (6)ACD/BCF (pH 7.4): 18.38; (7)ACD/KOC (pH 5.5): 237.19; (8)ACD/KOC (pH 7.4): 279.48; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.672; (14)Molar Refractivity: 61.2 cm³; (15)Molar Volume: 163.3 cm³; (16)Polarizability: 24.26×10^-24cm³; (17)Surface Tension: 51 dyne/cm; (18)Enthalpy of Vaporization: 71.56 kJ/mol; (19)Vapour Pressure: 5.87×10^-8 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC3Cc2c(c1ccccc1cc2)NC3
(2)InChI: InChI=1/C13H13NO/c15-11-7-10-6-5-9-3-1-2-4-12(9)13(10)14-8-11/h1-6,11,14-15H,7-8H2
(3)InChIKey: WKJMQLMWPMZUQH-UHFFFAOYAM

Product Name

3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline

3-Hydroxy-1,2,3,4-tetrahydrobenzo[h]quinoline Specification

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