Cas no 51583-62-1 (1,5-Naphthalenedione)
1,5-Naphthalenedione structure
Product Name:1,5-Naphthalenedione
CAS No:51583-62-1
MF:C10H6O2
MW:158.15344285965
CID:361944
PubChem ID:23498208
Update Time:2025-04-19
1,5-Naphthalenedione Chemical and Physical Properties
Names and Identifiers
-
- 1,5-Naphthalenedione
- naphthalene-1,5-dione
- SCHEMBL3883020
- 12679-43-5
- 1,5-Naphthoquinone
- Naphthalenedion
- 51583-62-1
- DTXSID601034129
-
- Inchi： 1S/C10H6O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1-6H
- InChI Key： UKYHUQYCBBUNIA-UHFFFAOYSA-N
- SMILES： O=C1C=CC=C2C(C=CC=C21)=O
Computed Properties
- Exact Mass: 158.03678
- Monoisotopic Mass: 158.036779430g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 341
- 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: 1.3
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
1,5-Naphthalenedione Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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