Cas no 53658-03-0 (4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile)
![4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile structure](https://ossimg.kuujia.com/scimg/54000/53658-03-0x500.png)
53658-03-0 structure
Product Name:4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile
CAS No:53658-03-0
MF:C22H16N2O2
MW:340.374645233154
CID:1582949
PubChem ID:14116741
Update Time:2025-04-21
4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile
- NSC727340
- 1,4-Bis(4-cyanophenoxymethyl)benzene
- Benzonitrile, 4,4'-[1,4-phenylenebis(methyleneoxy)]bis-
- 4,4'-p-Xylylendioxy-di-benzonitril
- AGN-PC-000G2U
- 4,4-phenylenebis(methyleneoxy)]bisbenzonitrile
- 1.4-Bis-[(4-cyan-phenoxy)-methyl]-benzol
- 4,4'-p-xylylenedioxy-di-benzonitrile
- NSC727340; 1,4-Bis(4-cyanophenoxymethyl)benzene; Benzonitrile, 4,4'-[1,4-phenylenebis(methyleneoxy)]bis-; 4,4'-p-Xylylendioxy-di-benzonitril; AGN-PC-000G2U; 4,4-phenylenebis(methyleneoxy)]bisbenzonitrile; 1.4-Bis-[(4-cyan-phenoxy)-methyl]-benzol; 4,4'-p-xylylenedioxy-di-benzonitrile;
- 53658-03-0
- DTXSID10556129
- 4,4'-[1,4-Phenylenebis(methyleneoxy)]dibenzonitrile
- C22H16N2O2
- NSC-727340
-
- Inchi： 1S/C22H16N2O2/c23-13-17-5-9-21(10-6-17)25-15-19-1-2-20(4-3-19)16-26-22-11-7-18(14-24)8-12-22/h1-12H,15-16H2
- InChI Key： KISAWPXPYQSTQQ-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C#N)=CC=1)CC1C=CC(=CC=1)COC1C=CC(C#N)=CC=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: 459
- 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
- LogP: 4.58796
4-[[4-[(4-cyanophenoxy)methyl]phenyl]methoxy]benzonitrile Related Literature
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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