1,4-Dichloroisoquinoline supplier

Name
1,4-Dichloroisoquinoline
EINECS
CAS No. 15298-58-5
Density 1.407 g/cm³
Solubility
Melting Point 92-94 °C
Formula C₉H₅Cl₂N
Boiling Point 310.9 °C at 760 mmHg
Molecular Weight 198.05
Flash Point 170.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,4-DICHLOROISOQUINOLINE
PSA 12.89000
LogP 3.54160

1,4-Dichloroisoquinoline Specification

The Isoquinoline,1,4-dichloro- has CAS registry number 15298-58-5. This chemical's molecular formula is C₉H₅Cl₂N and molecular weight is 198.05. What's more, its IUPAC name is 1,4-Dichloroisoquinoline.

Physical properties about the Isoquinoline,1,4-dichloro- are: (1)ACD/LogP: 3.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.4; (4)ACD/LogD (pH 7.4): 3.4; (5)ACD/BCF (pH 5.5): 225.47; (6)ACD/BCF (pH 7.4): 225.47; (7)ACD/KOC (pH 5.5): 1682.49; (8)ACD/KOC (pH 7.4): 1682.5; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.66; (14)Molar Refractivity: 51.97 cm³; (15)Molar Volume: 140.6 cm³; (16)Surface Tension: 51.5 dyne/cm; (17)Density: 1.407 g/cm³; (18)Flash Point: 170.8 °C; (19)Enthalpy of Vaporization: 52.98 kJ/mol; (20)Boiling Point: 310.9 °C at 760 mmHg; (21)Vapour Pressure: 0.00107 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2c1ccccc1c(Cl)nc2
(2) InChI: InChI=1/C9H5Cl2N/c10-8-5-12-9(11)7-4-2-1-3-6(7)8/h1-5H
(3) InChIKey: HAOKHVBZPIURMZ-UHFFFAOYAH

Product Name

1,4-Dichloroisoquinoline

1,4-Dichloroisoquinoline Specification

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