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Merimine

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Name

Merimine

EINECS N/A
CAS No. 496-13-9 Density 1.115 g/cm3
PSA 24.92000 LogP 1.01360
Solubility N/A Melting Point N/A
Formula C7H8N2 Boiling Point 212.4 °C at 760 mmHg
Molecular Weight 120.154 Flash Point 82.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 496-13-9 (2,3-DIHYDRO-1H-PYRROLO[3,4-C]PYRIDINE) Hazard Symbols N/A
Synonyms

2,3-Dihydro-1H-pyrrolo[3,4-c]pyridine;

Article Data 6

Merimine Specification

This chemical is called 1H-Pyrrolo[3,4-c]pyridine,2,3-dihydro-, and its systematic name is 2,3-dihydro-1H-pyrrolo[3,4-c]pyridine. With the molecular formula of C7H8N2, its molecular weight is 120.15. The CAS registry number of this chemical is 496-13-9. Additionally, its product category is Pyrrolidine.

Other characteristics of the 1H-Pyrrolo[3,4-c]pyridine,2,3-dihydro- can be summarised as followings: (1)ACD/LogP: -0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.6; (4)ACD/LogD (pH 7.4): -0.54; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 11.33; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 16.13 Å2; (13)Index of Refraction: 1.567; (14)Molar Refractivity: 35.25 cm3; (15)Molar Volume: 107.7 cm3; (16)Polarizability: 13.97×10-24cm3; (17)Surface Tension: 45.8 dyne/cm; (18)Density: 1.114 g/cm3; (19)Flash Point: 82.3 °C; (20)Enthalpy of Vaporization: 44.87 kJ/mol; (21)Boiling Point: 212.4 °C at 760 mmHg; (22)Vapour Pressure: 0.173 mmHg at 25°C.  

You can still convert the following datas into molecular structure:
1.SMILES: n1ccc2c(c1)CNC2
2.InChI: InChI=1/C7H8N2/c1-2-8-4-7-5-9-3-6(1)7/h1-2,4,9H,3,5H2
3.InChIKey: HIACNNDCIUUION-UHFFFAOYAU

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