Cas no 61441-06-3 (2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one)
![2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one structure](https://ossimg.kuujia.com/scimg/61500/61441-06-3x500.png)
61441-06-3 structure
Product Name:2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one
CAS No:61441-06-3
MF:C16H14O4
MW:270.279964923859
CID:954503
PubChem ID:329386
Update Time:2025-04-19
2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one Chemical and Physical Properties
Names and Identifiers
-
- 2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one
- 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one
- NSC-311735
- 61441-06-3
- DTXSID40317149
- NSC311735
-
- Inchi： 1S/C16H14O4/c1-18-14-7-12-11-6-4-3-5-10(11)9-20-16(17)13(12)8-15(14)19-2/h3-8H,9H2,1-2H3
- InChI Key： FGADTCKUSPLWPZ-UHFFFAOYSA-N
- SMILES： O1C(C2C=C(C(=CC=2C2C=CC=CC=2C1)OC)OC)=O
Computed Properties
- Exact Mass: 270.08922
- Monoisotopic Mass: 270.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 356
- 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: 2.9
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
2,3-dimethoxy-7h-benzo[d][2]benzoxepin-5-one Related Literature
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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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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