Cas no 10437-96-4 (1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)-)
10437-96-4 structure
Product Name:1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)-
CAS No:10437-96-4
MF:C13H10O4
MW:230.216104030609
CID:232790
PubChem ID:260509
Update Time:2025-04-19
1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)-
- 2-(3-oxobutanoyl)indene-1,3-dione
- 2-(3-oxobutanoyl)-1h-indene-1,3(2h)-dione
- AC1L63AT
- AC1Q5CED
- AG-J-35694
- AR-1C7422
- CTK4A3001
- NSC91855
- NSC-91855
- SCHEMBL15976145
- DTXSID70293745
- 10437-96-4
-
- Inchi： 1S/C13H10O4/c1-7(14)6-10(15)11-12(16)8-4-2-3-5-9(8)13(11)17/h2-5,11H,6H2,1H3
- InChI Key： YJWDIKOFEFCHJX-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2C(C1C(CC(C)=O)=O)=O
Computed Properties
- Exact Mass: 230.0579
- Monoisotopic Mass: 230.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 372
- 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: 1.2
- Topological Polar Surface Area: 68.3?2
Experimental Properties
- Density: 1.331
- Boiling Point: 433.2°Cat760mmHg
- Flash Point: 185.2°C
- Refractive Index: 1.575
- PSA: 68.28
- LogP: 1.23000
1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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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
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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
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
10437-96-4 (1H-Indene-1,3(2H)-dione,2-(1,3-dioxobutyl)-) Related Products
- 83-33-0(2,3-dihydro-1H-inden-1-one)
- 24623-20-9(6-Methyl-1-indanone)
- 4600-82-2(5-Ethyl-2,3-dihydro-1H-inden-1-one)
- 1785-95-1(2-Benzoyl-1,3-indandione)
- 16618-72-7(3-Phenyl-1-indanone)
- 4593-38-8(5-Methyl-1-indanone)
- 6072-57-7(3-Methyl-2,3-dihydro-1H-inden-1-one)
- 17496-14-9(2-methylindan-1-one)
- 24644-78-8(4-Methyl-2,3-dihydro-1H-inden-1-one)
- 1590-08-5(2-methyl-1,2,3,4-tetrahydronaphthalen-1-one)
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