3-Quinolinecarbonitrile,4-chloro-7-nitro- supplier

Name
3-Quinolinecarbonitrile, 4-chloro-7-nitro-
EINECS
CAS No. 364794-13-8
Density 1.556 g/cm³
Solubility
Melting Point
Formula C₁₀H₄ClN₃O₂
Boiling Point 440.509 °C at 760 mmHg
Molecular Weight 233.614
Flash Point 220.212 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chloro-7-nitroquinoline-3-carbonitrile;
PSA 82.50000
LogP 3.19128

3-Quinolinecarbonitrile,4-chloro-7-nitro- Specification

The 3-Quinolinecarbonitrile,4-chloro-7-nitro-, with the CAS registry number 364794-13-8, is also known as 4-Chlor-7-nitrochinolin-3-carbonitril. This chemical's molecular formula is C₁₀H₄ClN₃O₂ and molecular weight is 233.6107. What's more, its systematic name is called 4-Chloro-7-nitroquinoline-3-carbonitrile.

Physical properties about 3-Quinolinecarbonitrile,4-chloro-7-nitro- are: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 18; (6)ACD/BCF (pH 7.4): 18; (7)ACD/KOC (pH 5.5): 280; (8)ACD/KOC (pH 7.4): 280; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 82.5 Å²; (13)Index of Refraction: 1.692; (14)Molar Refractivity: 57.537 cm³; (15)Molar Volume: 150.141 cm³; (16)Surface Tension: 79.039 dyne/cm; (17)Density: 1.556 g/cm³; (18)Flash Point: 220.212 °C; (19)Enthalpy of Vaporization: 69.765 kJ/mol; (20)Boiling Point: 440.509 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=N(=O)c1cc2ncc(C#N)c(Cl)c2cc1
(2) InChI: InChI=1/C10H4ClN3O2/c11-10-6(4-12)5-13-9-3-7(14(15)16)1-2-8(9)10/h1-3,5H
(3) InChIKey: HMDDXDBCJORGSG-UHFFFAOYAV

Product Name

3-Quinolinecarbonitrile, 4-chloro-7-nitro-

3-Quinolinecarbonitrile,4-chloro-7-nitro- Specification

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