Cas no 503829-93-4 (Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)-)
![Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)- structure](https://ossimg.kuujia.com/scimg/504000/503829-93-4x500.png)
503829-93-4 structure
Product Name:Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)-
CAS No:503829-93-4
MF:C20H15NO
MW:285.339205026627
CID:1566262
PubChem ID:9120345
Update Time:2025-04-21
Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)-
- AKOS001219305
- 503829-93-4
- AB01333211-02
- DB-423681
- 3-(biphenyl-4-ylmethoxy)benzonitrile
- 3-([1,1'-Biphenyl]-4-ylmethoxy)benzonitrile
- SCHEMBL1249009
- NCGC00340404-01
- 3-(biphenyl-4-ylmethoxy)-benzonitrile
- KZJMOYAYPSJTNG-UHFFFAOYSA-N
-
- Inchi： 1S/C20H15NO/c21-14-17-5-4-8-20(13-17)22-15-16-9-11-19(12-10-16)18-6-2-1-3-7-18/h1-13H,15H2
- InChI Key： KZJMOYAYPSJTNG-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C#N)C=1)CC1C=CC(=CC=1)C1C=CC=CC=1
Computed Properties
- Exact Mass: 285.11545
- Monoisotopic Mass: 285.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 370
- 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: 4.7
- Topological Polar Surface Area: 33?2
Experimental Properties
- PSA: 33.02
Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)- Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
503829-93-4 (Benzonitrile, 3-([1,1'-biphenyl]-4-ylmethoxy)-) Related Products
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