Cas no 802918-42-9 (1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone)
802918-42-9 structure
Product Name:1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone
CAS No:802918-42-9
MF:C12H14O2
MW:190.238363742828
CID:2120262
PubChem ID:59700317
Update Time:2025-04-21
1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone Chemical and Physical Properties
Names and Identifiers
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- 1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone
- DB-290820
- SCHEMBL4802653
- 802918-42-9
-
- Inchi： 1S/C12H14O2/c1-8(13)9-4-2-6-11-10(9)5-3-7-12(11)14/h2,4,6,12,14H,3,5,7H2,1H3
- InChI Key： JIBOXEBZLBEUKJ-UHFFFAOYSA-N
- SMILES： OC1C2C=CC=C(C(C)=O)C=2CCC1
Computed Properties
- Exact Mass: 190.099379685Da
- Monoisotopic Mass: 190.099379685Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 224
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 37.3?2
1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
802918-42-9 (1-(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)ethanone) Related Products
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