Cas no 1988-19-8 (1-Naphthalenol,formate(9CI))
1-Naphthalenol,formate(9CI) structure
Product Name:1-Naphthalenol,formate(9CI)
CAS No:1988-19-8
MF:C11H8O2
MW:172.180023193359
CID:856159
PubChem ID:13530810
Update Time:2025-04-19
1-Naphthalenol,formate(9CI) Chemical and Physical Properties
Names and Identifiers
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- 1-Naphthalenol,formate(9CI)
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- Inchi: 1S/C11H8O2/c12-8-13-11-7-3-5-9-4-1-2-6-10(9)11/h1-8H
- InChI Key: JVZGDJJGLDKFRF-UHFFFAOYSA-N
- SMILES: O=COC1C2C(=CC=CC=2)C=CC=1
Computed Properties
- Exact Mass: 172.05244
- Monoisotopic Mass: 172.052429494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 179
- 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: 3.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
1-Naphthalenol,formate(9CI) Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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