1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline supplier

Name
1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline
EINECS
CAS No. 886759-47-3
Density 1.058 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₇N
Boiling Point 303.733 °C at 760 mmHg
Molecular Weight 187.28
Flash Point 143.207 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline;Isoquinoline, 1-cyclobutyl-1,2,3,4-tetrahydro-
PSA 12.03000
LogP 3.00230

1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline Specification

This chemical is called 1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline, and it can also be named as isoquinoline, 1-cyclobutyl-1,2,3,4-tetrahydro-. With the molecular formula of C₁₃H₁₇N, its molecular weight is 187.28. The CAS registry number of this chemical is 886759-47-3.

Other characteristics of the 1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline can be summarised as followings: (1)ACD/LogP: 2.99; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 12.03 Å²; (7)Index of Refraction: 1.573; (8)Molar Refractivity: 58.266 cm³; (9)Molar Volume: 176.923 cm³; (10)Polarizability: 23.098×10^-24cm³; (11)Surface Tension: 42.831 dyne/cm; (12)Density: 1.059 g/cm³; (13)Flash Point: 143.207 °C; (14)Enthalpy of Vaporization: 54.405 kJ/mol; (15)Boiling Point: 303.733 °C at 760 mmHg; (16)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1ccc2c(c1)C(NCC2)C3CCC3
2.InChI: InChI=1/C13H17N/c1-2-7-12-10(4-1)8-9-14-13(12)11-5-3-6-11/h1-2,4,7,11,13-14H,3,5-6,8-9H2
3.InChIKey: BZKHQILNYWQRIO-UHFFFAOYAV

Product Name

1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline

1-Cyclobutyl-1,2,3,4-tetrahydroisoquinoline Specification

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