9,9'-(1,3-Phenylene)bis-9H-carbazole supplier

Name
9,9'-(1,3-Phenylene)bis-9H-carbazole
EINECS
CAS No. 550378-78-4
Article Data12
CAS DataBase
Density 1.212 g/cm³
Solubility
Melting Point 176-178°C
Formula C₃₀H₂₀N₂
Boiling Point 644.203 °C at 760 mmHg
Molecular Weight 408.502
Flash Point 343.402 °C
Transport Information
Appearance
Safety 26-36/37/39-41-37/38
Risk Codes 37/38-41
Molecular Structure
Hazard Symbols Xi
Synonyms 1,3-Bis(N-carbazolyl)benzene;1,3-Bis(carbazol-9-yl)benzene;1,3-Di-(9-carbazolyl)benzene;MCP(carbazole derivative);N,N'-Dicarbazolyl-3,5-benzene;
PSA 9.86000
LogP 7.88080

9,9'-(1,3-Phenylene)bis-9H-carbazole Specification

The CAS register number of 9,9'-(1,3-Phenylene)bis-9H-carbazole is 550378-78-4. It also can be called as 9H-Carbazole,9,9'-(1,3-phenylene)bis- and the systematic name about this chemical is 9,9'-benzene-1,3-diylbis(9H-carbazole). The molecular formula about this chemical is C₃₀H₂₀N₂and the molecular weight is 408.49.

Physical properties about 9,9'-(1,3-Phenylene)bis-9H-carbazole are: (1)ACD/LogP: 8.74; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10; (4)ACD/LogD (pH 7.4): 10; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 8174394; (8)ACD/KOC (pH 7.4): 8174394; (9)#H bond acceptors: 2 ; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.86Å²; (12)Index of Refraction: 1.704; (13)Molar Refractivity: 130.877 cm³; (14)Molar Volume: 337.105 cm³; (15)Polarizability: 51.884x10^-24cm³; (16)Surface Tension: 50.205 dyne/cm; (17)Enthalpy of Vaporization: 95.047 kJ/mol; (18)Boiling Point: 644.203 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cccc3c1c2ccccc2n3c4cccc(c4)n7c5ccccc5c6ccccc67
(2)InChI: InChI=1/C30H20N2/c1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-20H
(3)InChIKey: MZYDBGLUVPLRKR-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C30H20N2/c1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-20H
(5)Std. InChIKey: MZYDBGLUVPLRKR-UHFFFAOYSA-N

Product Name

9,9'-(1,3-Phenylene)bis-9H-carbazole

9,9'-(1,3-Phenylene)bis-9H-carbazole Specification

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