Cas no 90059-76-0 (2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]-)
![2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]- structure](https://ossimg.kuujia.com/scimg/90500/90059-76-0x500.png)
90059-76-0 structure
Product Name:2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]-
CAS No:90059-76-0
MF:C16H14O8
MW:334.277565479279
CID:795133
PubChem ID:13167346
Update Time:2025-04-19
2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]-
- (5,7-diacetyloxy-2-oxochromen-4-yl)methyl acetate
- 90059-76-0
- DTXSID00524256
- 4-[(Acetyloxy)methyl]-2-oxo-2H-1-benzopyran-5,7-diyl diacetate
-
- Inchi： 1S/C16H14O8/c1-8(17)21-7-11-4-15(20)24-14-6-12(22-9(2)18)5-13(16(11)14)23-10(3)19/h4-6H,7H2,1-3H3
- InChI Key： BIGQBJODSXLOAH-UHFFFAOYSA-N
- SMILES： O1C(C=C(COC(C)=O)C2C(=CC(=CC1=2)OC(C)=O)OC(C)=O)=O
Computed Properties
- Exact Mass: 334.06886740g/mol
- Monoisotopic Mass: 334.06886740g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 24
- Rotatable Bond Count: 7
- Complexity: 579
- 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: 0.7
- Topological Polar Surface Area: 105?2
2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
90059-76-0 (2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[(acetyloxy)methyl]-) Related Products
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