Cas no 170378-70-8 (2,1-Benzisoxazole, 5,5'-methylenebis[3-phenyl-)
170378-70-8 structure
Product Name:2,1-Benzisoxazole, 5,5'-methylenebis[3-phenyl-
CAS No:170378-70-8
MF:C27H18N2O2
MW:402.444026470184
CID:1352617
Update Time:2024-08-17
2,1-Benzisoxazole, 5,5'-methylenebis[3-phenyl- Chemical and Physical Properties
Names and Identifiers
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- 2,1-Benzisoxazole, 5,5'-methylenebis[3-phenyl-
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- Inchi： 1S/C27H18N2O2/c1-3-7-20(8-4-1)26-22-16-18(11-13-24(22)28-30-26)15-19-12-14-25-23(17-19)27(31-29-25)21-9-5-2-6-10-21/h1-14,16-17H,15H2
- InChI Key： MTHFFVJJWGQDKD-UHFFFAOYSA-N
- SMILES： C(C1C=CC2C(C=1)=C(C1=CC=CC=C1)ON=2)C1C=CC2C(C=1)=C(C1=CC=CC=C1)ON=2
Computed Properties
- Exact Mass: 402.13694
Experimental Properties
- Density: 1.258±0.06 g/cm3(Predicted)
- Boiling Point: 647.9±50.0 °C(Predicted)
- PSA: 52.06
- pka: -1.73±0.30(Predicted)
2,1-Benzisoxazole, 5,5'-methylenebis[3-phenyl- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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