Cas no 64218-56-0 (5,6-Isobenzofurandicarboxaldehyde, 1,3-diphenyl-)
64218-56-0 structure
Product Name:5,6-Isobenzofurandicarboxaldehyde, 1,3-diphenyl-
CAS No:64218-56-0
MF:C22H14O3
MW:326.344766139984
CID:424546
PubChem ID:12352249
Update Time:2025-04-19
5,6-Isobenzofurandicarboxaldehyde, 1,3-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 5,6-Isobenzofurandicarboxaldehyde, 1,3-diphenyl-
- 1,3-diphenyl-2-benzofuran-5,6-dicarbaldehyde
- DTXSID20493430
- 64218-56-0
- 1,3-diphenylisobenzofuran-5,6-dicarbaldehyde
-
- Inchi： 1S/C22H14O3/c23-13-17-11-19-20(12-18(17)14-24)22(16-9-5-2-6-10-16)25-21(19)15-7-3-1-4-8-15/h1-14H
- InChI Key： DOYSNJDSLSMSMV-UHFFFAOYSA-N
- SMILES： O1C(C2C=CC=CC=2)=C2C=C(C=O)C(C=O)=CC2=C1C1C=CC=CC=1
Computed Properties
- Exact Mass: 326.09432
- Monoisotopic Mass: 326.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 25
- Rotatable Bond Count: 4
- Complexity: 422
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 47.3?2
Experimental Properties
- PSA: 47.28
5,6-Isobenzofurandicarboxaldehyde, 1,3-diphenyl- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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