Cas no 40815-72-3 (1,4-Naphthalenedione,2-(2-propen-1-yloxy)-)
40815-72-3 structure
Product Name:1,4-Naphthalenedione,2-(2-propen-1-yloxy)-
CAS No:40815-72-3
MF:C13H10O3
MW:214.216703891754
CID:334763
PubChem ID:260635
Update Time:2025-04-19
1,4-Naphthalenedione,2-(2-propen-1-yloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione,2-(2-propen-1-yloxy)-
- 2-prop-2-enoxynaphthalene-1,4-dione
- 2-(prop-2-en-1-yloxy)naphthalene-1,4-dione
- 2-Allyloxy-[1,4]naphthochinon
- 2-allyloxy-[1,4]naphthoquinone
- 2-Allyloxy-1,4-naphthochinon
- 2-allyloxy-1,4-naphthoquinone
- AC1L63K5
- AC1Q6B5H
- allyloxy-1,4-naphthoquinone
- AR-1C9774
- CHEMBL2059372
- CTK4I3820
- NSC92196
- O-allyl lawsone
- SureCN8473068
- SCHEMBL8473068
- DTXSID90293782
- 40815-72-3
- GJJKARQHSXJKNX-UHFFFAOYSA-N
- NSC-92196
-
- Inchi: 1S/C13H10O3/c1-2-7-16-12-8-11(14)9-5-3-4-6-10(9)13(12)15/h2-6,8H,1,7H2
- InChI Key: GJJKARQHSXJKNX-UHFFFAOYSA-N
- SMILES: O(CC=C)C1=CC(C2C=CC=CC=2C1=O)=O
Computed Properties
- Exact Mass: 214.063
- Monoisotopic Mass: 214.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 354
- 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
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- Density: 1.22
- Boiling Point: 369.4°C at 760 mmHg
- Flash Point: 165.7°C
- Refractive Index: 1.584
- PSA: 43.37
- LogP: 2.15210
1,4-Naphthalenedione,2-(2-propen-1-yloxy)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
40815-72-3 (1,4-Naphthalenedione,2-(2-propen-1-yloxy)-) Related Products
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