Cas no 917981-08-9 (Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis-)
![Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis- structure](https://ossimg.kuujia.com/scimg/918000/917981-08-9x500.png)
917981-08-9 structure
Product Name:Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis-
CAS No:917981-08-9
MF:C21H22N2O2
MW:334.411585330963
CID:780419
PubChem ID:71427924
Update Time:2025-04-19
Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis-
- 2-[7-(2-cyanophenoxy)heptoxy]benzonitrile
- DTXSID70846659
- 2,2'-[Heptane-1,7-diylbis(oxy)]dibenzonitrile
- 917981-08-9
-
- Inchi： 1S/C21H22N2O2/c22-16-18-10-4-6-12-20(18)24-14-8-2-1-3-9-15-25-21-13-7-5-11-19(21)17-23/h4-7,10-13H,1-3,8-9,14-15H2
- InChI Key： KPGPUBZPQNNQAM-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1C#N)CCCCCCCOC1C=CC=CC=1C#N
Computed Properties
- Exact Mass: 334.168127949g/mol
- Monoisotopic Mass: 334.168127949g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 10
- Complexity: 419
- 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: 5
- Topological Polar Surface Area: 66?2
Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
917981-08-9 (Benzonitrile, 2,2'-[1,7-heptanediylbis(oxy)]bis-) Related Products
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