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Basic Information
CAS No.: 98490-61-0
Name: 5-chloro-1,2,3,4-tetrahydro-1,6-naphthyridine
Molecular Structure:
Molecular Structure of 98490-61-0 (5-chloro-1,2,3,4-tetrahydro-1,6-naphthyridine)
Formula: C8H9ClN2
Molecular Weight: 168.6235
Synonyms: 5-chloro-1,2,3,4-tetrahydro-1,6-naphthyridine
Density: 1.226 g/cm3
Boiling Point: 316.2 °C at 760 mmHg
Flash Point: 145 °C
PSA: 24.92000
LogP: 2.23110
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Specification

The 1,6-Naphthyridine,5-chloro-1,2,3,4-tetrahydro-, with the CAS registry number 98490-61-0, belongs to the product category of Chiral Chemicals. This chemical's molecular formula is C8H9ClN2 and molecular weight is 168.6235. Its systematic name is called 5-chloro-1,2,3,4-tetrahydro-1,6-naphthyridine.

Physical properties of 1,6-Naphthyridine,5-chloro-1,2,3,4-tetrahydro-: (1)ACD/LogP: 2.00; (2)ACD/LogD (pH 5.5): 1.8; (3)ACD/LogD (pH 7.4): 2; (4)#H bond acceptors: 2; (5)#H bond donors: 1; (6)Index of Refraction: 1.564; (7)Molar Refractivity: 44.76 cm3; (8)Molar Volume: 137.4 cm3; (9)Surface Tension: 45.1 dyne/cm; (10)Density: 1.226 g/cm3; (11)Flash Point: 145 °C; (12)Enthalpy of Vaporization: 55.75 kJ/mol; (13)Boiling Point: 316.2 °C at 760 mmHg; (14)Vapour Pressure: 0.000417 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cnc(c2c1NCCC2)Cl
(2)InChI: InChI=1/C8H9ClN2/c9-8-6-2-1-4-10-7(6)3-5-11-8/h3,5,10H,1-2,4H2
(3)InChIKey: JVMIUCCIXSCUTR-UHFFFAOYAA