Cas no 61947-43-1 (Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis-)
![Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis- structure](https://ossimg.kuujia.com/scimg/62000/61947-43-1x500.png)
61947-43-1 structure
Product Name:Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis-
CAS No:61947-43-1
MF:C22H16N2O2
MW:340.374645233154
CID:462649
PubChem ID:71391083
Update Time:2025-04-19
Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis-
- 3-[[3-[(3-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile
- DTXSID70812970
- 61947-43-1
- 3,3'-[1,3-Phenylenebis(methyleneoxy)]dibenzonitrile
-
- Inchi： 1S/C22H16N2O2/c23-13-17-4-2-8-21(11-17)25-15-19-6-1-7-20(10-19)16-26-22-9-3-5-18(12-22)14-24/h1-12H,15-16H2
- InChI Key： HNFKAPDSHUYOQS-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C#N)C=1)CC1C=CC=C(COC2C=CC=C(C#N)C=2)C=1
Computed Properties
- Exact Mass: 340.12128
- Monoisotopic Mass: 340.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 6
- Complexity: 485
- 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: 4.3
- Topological Polar Surface Area: 66?2
Experimental Properties
- PSA: 66.04
Benzonitrile, 3,3'-[1,3-phenylenebis(methyleneoxy)]bis- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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