Cas no 140242-23-5 (3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl-)
![3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl- structure](https://ossimg.kuujia.com/scimg/140500/140242-23-5x500.png)
140242-23-5 structure
Product Name:3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl-
CAS No:140242-23-5
MF:C21H16O3
MW:316.349946022034
CID:1287698
PubChem ID:15677670
Update Time:2025-04-20
3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl-
- 2,8-dimethoxy-9-phenylcyclopenta[a]naphthalen-3-one
- 2,8-DIMETHOXY-9-PHENYL-3H-CYCLOPENTA[A]NAPHTHALEN-3-ONE
- DTXSID90576729
- CHEMBL346744
- 140242-23-5
-
- Inchi： 1S/C21H16O3/c1-23-17-11-9-14-8-10-15-16(12-18(24-2)21(15)22)19(14)20(17)13-6-4-3-5-7-13/h3-12H,1-2H3
- InChI Key： UUPYUGFZHQOKDW-UHFFFAOYSA-N
- SMILES： COC1C(=O)C2C=CC3C(C=2C=1)=C(C1C=CC=CC=1)C(OC)=CC=3
Computed Properties
- Exact Mass: 316.10998
- Monoisotopic Mass: 316.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 505
- 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: 5
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
140242-23-5 (3H-Benz[e]inden-3-one, 2,8-dimethoxy-9-phenyl-) Related Products
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