Cas no 22037-31-6 (Pongachromene)
Pongachromene structure
Product Name:Pongachromene
CAS No:22037-31-6
MF:C22H18O6
MW:378.374726772308
CID:285881
Update Time:2024-02-29
Pongachromene Chemical and Physical Properties
Names and Identifiers
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- 4H,8H-Benzo[1,2-b:3,4-b']dipyran-4-one,2-(1,3-benzodioxol-5-yl)-3-methoxy-8,8-dimethyl-
- 4H,8H-Benzo[1,2-b:3,4-b']dipyran-4-one,3-methoxy-8,8-dimethyl-2-[3,4-(methylenedioxy)phenyl]- (8CI)
- Pongachromen
- Pongachromene
- LMPK12111563
- 2-(1,3-benzodioxol-5-yl)-3-methoxy-8,8-dimethyl-4h,8h-benzo[1,2-b:3,4-b']dipyran-4-one
- 2-(1,3-benzodioxol-5-yl)-3-methoxy-8,8-dimethyl-pyrano[2,3-f]chromen-4-one
- 3-Methoxy-8,8-dimethyl-2-[3,4-(methylenedioxy)phenyl]-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
-
- Inchi： 1S/C22H18O6/c1-22(2)9-8-13-15(28-22)7-5-14-18(23)21(24-3)19(27-20(13)14)12-4-6-16-17(10-12)26-11-25-16/h4-10H,11H2,1-3H3
- InChI Key： SVCOJIPWISPOJZ-UHFFFAOYSA-N
- SMILES： O1C2C=CC3C(C(=C(C4=CC=C5C(=C4)OCO5)OC=3C=2C=CC1(C)C)OC)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 28
- Rotatable Bond Count: 2
- Complexity: 710
- Topological Polar Surface Area: 63.2
- XLogP3: 2.844
Pongachromene Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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