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5,6,7,8-Tetrahydro-[1,7]naphthyridine

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Name

5,6,7,8-Tetrahydro-[1,7]naphthyridine

EINECS 604-604-1
CAS No. 13623-85-3 Density 1.068 g/cm3
PSA 24.92000 LogP 1.05610
Solubility N/A Melting Point 275 °C(Solv: ethanol (64-17-5); chloroform (67-66-3))
Formula C8H10N2 Boiling Point 247.6 °C at 760 mmHg
Molecular Weight 134.181 Flash Point 103.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 13623-85-3 (5,6,7,8-TETRAHYDRO-[1,7]NAPHTHYRIDINE) Hazard Symbols N/A
Synonyms

5,6,7,8-TETRAHYDRO-[1,7]NAPHTHYRIDINE;5,6,7,8-Tetrahydro[[1,7]-naphthyridin;1,7-Naphthyridine, 5,6,7,8-tetrahydro-

 

5,6,7,8-Tetrahydro-[1,7]naphthyridine Specification

This chemical is called  5,6,7,8-Tetrahydro-[1,7]naphthyridine, and it can also be named as 1,7-naphthyridine, 5,6,7,8-tetrahydro-. With the molecular formula of C8H10N2, its molecular weight is 134.18. The CAS registry number of this chemical is 13623-85-3.

Other characteristics of the 5,6,7,8-Tetrahydro-[1,7]naphthyridine can be summarised as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 9.56; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 16.13 Å2; (10)Index of Refraction: 1.548; (11)Molar Refractivity: 39.86 cm3; (12)Molar Volume: 125.5 cm3; (13)Polarizability: 15.8×10-24cm3; (14)Surface Tension: 42.4 dyne/cm; (15)Density: 1.068 g/cm3; (16)Flash Point: 103.6 °C; (17)Enthalpy of Vaporization: 48.48 kJ/mol; (18)Boiling Point: 247.6 °C at 760 mmHg; (19)Vapour Pressure: 0.0254 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: n1cccc2c1CNCC2
2.InChI: InChI=1/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h1-2,4,9H,3,5-6H2
3.InChIKey: SRQJSMFCZYZSLB-UHFFFAOYAW
4.Std. InChI: InChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h1-2,4,9H,3,5-6H2
5.Std. InChIKey: SRQJSMFCZYZSLB-UHFFFAOYSA-N

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