Cas no 2397-59-3 (1,4-Naphthalenedione,2,3-diethyl-)
2397-59-3 structure
Product Name:1,4-Naphthalenedione,2,3-diethyl-
CAS No:2397-59-3
MF:C14H14O2
MW:214.259764194489
CID:270281
PubChem ID:3011754
Update Time:2025-04-19
1,4-Naphthalenedione,2,3-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione,2,3-diethyl-
- 2,3-diethylnaphthalene-1,4-dione
- 1,4-Naphthoquinone, 2,3-diethyl-
- 2,3-Diethyl-1,4-naphthoquinone
- starbld0033322
- DTXSID00178692
- SCHEMBL5820931
- 2397-59-3
-
- Inchi： 1S/C14H14O2/c1-3-9-10(4-2)14(16)12-8-6-5-7-11(12)13(9)15/h5-8H,3-4H2,1-2H3
- InChI Key： AAHIKPPSMXWKAV-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2C(C(CC)=C1CC)=O
Computed Properties
- Exact Mass: 214.09942
- Monoisotopic Mass: 214.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 318
- 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: 2.7
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- Density: 1.106
- Boiling Point: 340.9°C at 760 mmHg
- Flash Point: 127.9°C
- Refractive Index: 1.548
- PSA: 34.14
1,4-Naphthalenedione,2,3-diethyl- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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