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4-Quinolinamine, 2-chloro-

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Name

4-Quinolinamine, 2-chloro-

EINECS N/A
CAS No. 80947-25-7 Density 1.363 g/cm3
PSA 38.91000 LogP 3.05160
Solubility N/A Melting Point 250℃
Formula C9H7ClN2 Boiling Point 365.857 °C at 760 mmHg
Molecular Weight 178.621 Flash Point 175.064 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 80947-25-7 (4-AMINO-2-CHLOROQUINOLINE) Hazard Symbols N/A
Synonyms

(2-Chloroquinolin-4-yl)amine;

Article Data 8

4-Quinolinamine, 2-chloro- Specification

The 4-Quinolinamine, 2-chloro-, with the CAS registry number 80947-25-7, is also known as (2-Chloroquinolin-4-yl)amine. It belongs to the product category of Api Intermediates. This chemical's molecular formula is C9H7ClN2 and molecular weight is 178.61828. What's more, its IUPAC name is 2-Chloroquinolin-4-amine. 

Physical properties about 4-Quinolinamine, 2-chloro- are: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 47; (6)ACD/BCF (pH 7.4): 50; (7)ACD/KOC (pH 5.5): 543; (8)ACD/KOC (pH 7.4): 572; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.91 Å2; (13)Index of Refraction: 1.712; (14)Molar Refractivity: 51.318 cm3; (15)Molar Volume: 131.004 cm3; (16)Polarizability: 20.344×10-24 cm3; (17)Surface Tension: 61.564 dyne/cm; (18)Density: 1.363 g/cm3; (19)Flash Point: 175.064 °C; (20)Enthalpy of Vaporization: 61.22 kJ/mol; (21)Boiling Point: 365.857 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Nc1cc(Cl)nc2ccccc12
(2) InChI: InChI=1/C9H7ClN2/c10-9-5-7(11)6-3-1-2-4-8(6)12-9/h1-5H,(H2,11,12)
(3) InChIKey: QVCRGJALYOLXDC-UHFFFAOYAS

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