Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4,9-Dibromonaphtho[2,3-c][1,2,5]thiadiazole |
EINECS | N/A |
CAS No. | 18557-22-7 | Density | 2.073 g/cm3 |
PSA | 54.02000 | LogP | 4.36950 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H4Br2N2S | Boiling Point | 421.793 °C at 760 mmHg |
Molecular Weight | 344.029 | Flash Point | 208.893 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4,9-DIBROMONAPHTHO[2,3-C][1,2,5]THIADIAZOLE;4,9-Dibromonaphtho[2,3-c][1,2,5]thiadiazole ,97% |
Article Data | 6 |
The 4, 9-Dibromonaphtho[2, 3-c][1, 2, 5]thiadiazole has CAS registry number 18557-22-7. This chemical's molecular formula is C10H4Br2N2S and molecular weight is 344.02. What's more, its systematic name is 4, 9-dibromonaphtho[2, 3-c][1, 2, 5]thiadiazole.
Physical properties about 4, 9-Dibromonaphtho[2, 3-c][1, 2, 5]thiadiazole are: (1)ACD/LogP: 4.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 2716; (6)ACD/BCF (pH 7.4): 2716; (7)ACD/KOC (pH 5.5): 9992; (8)ACD/KOC (pH 7.4): 9992; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.02 Å2; (13)Index of Refraction: 1.814; (14)Molar Refractivity: 71.885 cm3; (15)Molar Volume: 165.961 cm3; (16)Polarizability: 28.497×10-24 cm3; (17)Surface Tension: 74.38 dyne/cm; (18)Density: 2.073 g/cm3; (19)Flash Point: 208.893 °C; (20)Enthalpy of Vaporization: 64.968 kJ/mol; (21)Boiling Point: 421.793 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc2c1ccccc1c(Br)c3nsnc23
(2) InChI: InChI=1/C10H4Br2N2S/c11-7-5-3-1-2-4-6(5)8(12)10-9(7)13-15-14-10/h1-4H
(3) InChIKey: XGTQHVQKGZSPIK-UHFFFAOYAP