-
Name
C-ISOQUINOLIN-8-YL-METHYLAMINE
- EINECS
- CAS No. 362606-12-0
- Article Data2
- CAS DataBase
- Density 1.156 g/cm3
- Solubility
- Melting Point
- Formula C10H10N2
- Boiling Point 330.8 °C at 760 mmHg
- Molecular Weight 158.203
- Flash Point 174.5 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 8-Aminomethylisoquinoline;
- PSA 38.91000
- LogP 2.39380
8-Isoquinolinemethanamine Specification
This chemical is called 8-Isoquinolinemethanamine, and its systematic name is 1-(Isoquinolin-8-yl)methanamine. With the molecular formula of C10H10N2, its molecular weight is 158.20. The CAS registry number of this chemical is 362606-12-0. Additionally, its product categories are Building Blocks; Isoquinoline.
Other characteristics of the 8-Isoquinolinemethanamine can be summarised as followings: (1)ACD/LogP: 0.83; (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; (6)ACD/KOC (pH 7.4): 1.8; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 38.91 Å2; (11)Index of Refraction: 1.662; (12)Molar Refractivity: 50.63 cm3; (13)Molar Volume: 136.7 cm3; (14)Polarizability: 20.07×10-24cm3; (15)Surface Tension: 54.2 dyne/cm; (16)Density: 1.156 g/cm3; (17)Flash Point: 174.5 °C; (18)Enthalpy of Vaporization: 57.35 kJ/mol; (19)Boiling Point: 330.8 °C at 760 mmHg; (20)Vapour Pressure: 0.000162 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: NCc1cccc2ccncc12
2.InChI: InChI=1/C10H10N2/c11-6-9-3-1-2-8-4-5-12-7-10(8)9/h1-5,7H,6,11H2
3.InChIKey: RTKXRSRADBUSHY-UHFFFAOYAX
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