Cas no 47375-13-3 ( )
structure
Product Name:
CAS No:47375-13-3
MF:C18H16N2O4
MW:324.330644607544
CID:930918
PubChem ID:709897
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- ethyl 2-cyano-3-[4-(2-cyano-3-ethoxy-3-oxoprop-1-enyl)phenyl]prop-2-enoate
- 1,4-Bis-< 2-ethoxycarbonyl-2-cyan-vinyl> -benzol
- 2,2-dicyano-3-(4-chlorophenyl)oxirane
- 2,2'-dicyano-3,3'-p-phenylene-di-acrylic acid diethyl ester
- 2,2-Oxiranedicarbonitrile, 3-(4-methoxyphenyl)-
- 3-(4-methoxy-phenyl)-oxirane-2,2-dicarbonitrile
- CTK1B1750
- ethyl 2-cyano-3-(4-(2-cyano-3-methoxy-3-oxoprop-1-enyl)phenyl)acrylate
- p-Phenylen-bis-methylencyanessigsaeureaethylester
- Terephthalyliden-tetracarbonsaeure-diethylester-dini
- STK041353
- AKOS000486103
- NSC121231
- diethyl (2Z,2'E)-3,3'-benzene-1,4-diylbis(2-cyanoprop-2-enoate)
- 47375-13-3
- diethyl 3,3'-(1,4-phenylene)bis(2-cyanoacrylate)
- ethyl (Z)-2-cyano-3-[4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]phenyl]prop-2-enoate
- NSC-121231
-
-
- Inchi： 1S/C18H16N2O4/c1-3-23-17(21)15(11-19)9-13-5-7-14(8-6-13)10-16(12-20)18(22)24-4-2/h5-10H,3-4H2,1-2H3/b15-9-,16-10+
- InChI Key： TUUWXQUTXGOUAI-CKOAPEAFSA-N
- SMILES： O(CC)C(/C(/C#N)=C\C1C=CC(/C=C(\C#N)/C(=O)OCC)=CC=1)=O
Computed Properties
- Exact Mass: 324.11108
- Monoisotopic Mass: 324.11100700g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 8
- Complexity: 566
- 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
- Topological Polar Surface Area: 100?2
Experimental Properties
- PSA: 100.18
- LogP: 2.62676
Related Literature
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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