1,3-Dichloro-6-fluoroisoquinoline supplier

Name
1,3-Dichloro-6-fluoroisoquinoline
EINECS
CAS No. 1041423-26-0
Density 1.491 g/cm³
Solubility
Melting Point 131-133 °C
Formula C₉H₄Cl₂FN
Boiling Point 332.3 °C at 760 mmHg
Molecular Weight 216.0392
Flash Point 154.7 °C
Transport Information
Appearance
Safety 26-36/37
Risk Codes 22-37/38-41
Molecular Structure
Hazard Symbols Xn
Synonyms Isoquinoline, 1,3-dichloro-6-fluoro-;
PSA 12.89000
LogP 3.68070

1,3-Dichloro-6-fluoroisoquinoline Specification

The 1,3-Dichloro-6-fluoroisoquinoline, with the CAS registry number 1041423-26-0, is also known as Isoquinoline, 1,3-dichloro-6-fluoro-. This chemical's molecular formula is C₉H₄Cl₂FN and molecular weight is 216.0392.

Physical properties about 1,3-Dichloro-6-fluoroisoquinoline are: (1)ACD/LogP: 3.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.36; (4)ACD/LogD (pH 7.4): 3.36; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 12.89 Å²; (9)Index of Refraction: 1.636; (10)Molar Refractivity: 51.97 cm³; (11)Molar Volume: 144.8 cm³; (12)Polarizability: 20.6×10^-24cm³; (13)Surface Tension: 49.4 dyne/cm; (14)Density: 1.491 g/cm³; (15)Flash Point: 154.7 °C; (16)Enthalpy of Vaporization: 55.22 kJ/mol; (17)Boiling Point: 332.3 °C at 760 mmHg; (18)Vapour Pressure: 0.000285 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cc2c(cc1F)cc(nc2Cl)Cl
(2) InChI: InChI=1/C9H4Cl2FN/c10-8-4-5-3-6(12)1-2-7(5)9(11)13-8/h1-4H
(3) InChIKey: BDAYBRFYRZTMGQ-UHFFFAOYAP

Product Name

1,3-Dichloro-6-fluoroisoquinoline

1,3-Dichloro-6-fluoroisoquinoline Specification

Related Products

Hot Products