Cas no 19806-12-3 (dibenzylidenebutanedioic acid)
dibenzylidenebutanedioic acid structure
Product Name:dibenzylidenebutanedioic acid
CAS No:19806-12-3
MF:C18H14O4
MW:294.301365375519
CID:908426
PubChem ID:11231690
Update Time:2025-04-19
dibenzylidenebutanedioic acid Chemical and Physical Properties
Names and Identifiers
-
- dibenzylidenebutanedioic acid
- dibenzylidene-succinic acid; 2,3-Butanedione,1,4-diphenyl-, 2,3-dioxime; AG-F-61037; 1,4-diphenyl-2,3-bis(hydroxyimino)butane; 1,4-Diphenyl-butan-2,3-dion-dioxim; CTK8I8150; 2,3-DIBENZYLIDENE SUCCINIC ACID; N-[(E)-3-nitroso-1,4-diphenylbut-2-en-2-yl]hydroxylamine; 1.4-Diphenyl-butadien-(1.3)-dicarbonsaeure-(2.3); dibenzylglyoxal dioxime; 1,4-diphenyl-butane-2,3-dione dioxime; CTK4I9850; Dibenzyliden-bernsteinsaeure; AKOS004900757; Diben
- NSC147398
- 2,3-Bis[(E)-benzylidene]butanedioic acid
- SCHEMBL4972255
- 19806-12-3
- (2E,3E)-2,3-dibenzylidenebutanedioic acid
- NSC-147398
-
- Inchi： 1S/C18H14O4/c19-17(20)15(11-13-7-3-1-4-8-13)16(18(21)22)12-14-9-5-2-6-10-14/h1-12H,(H,19,20)(H,21,22)/b15-11+,16-12+
- InChI Key： YRCUGKQNIYGAON-JOBJLJCHSA-N
- SMILES： OC(/C(=C/C1C=CC=CC=1)/C(/C(=O)O)=C\C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 294.08922
- Monoisotopic Mass: 294.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 420
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- PSA: 74.6
- LogP: 3.32280
dibenzylidenebutanedioic acid Related Literature
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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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
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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