Cas no 651027-16-6 (Butanenitrile, 4-(3-methoxyphenoxy)-)
651027-16-6 structure
Product Name:Butanenitrile, 4-(3-methoxyphenoxy)-
CAS No:651027-16-6
MF:C11H13NO2
MW:191.226423025131
CID:407699
PubChem ID:24702636
Update Time:2025-04-19
Butanenitrile, 4-(3-methoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Butanenitrile, 4-(3-methoxyphenoxy)-
- 4-(3-methoxyphenoxy)butanenitrile
- DTXSID60640880
- 651027-16-6
- AKOS000188015
-
- Inchi： 1S/C11H13NO2/c1-13-10-5-4-6-11(9-10)14-8-3-2-7-12/h4-6,9H,2-3,8H2,1H3
- InChI Key： YRHFWSFUTMFYBJ-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C=1)OC)CCCC#N
Computed Properties
- Exact Mass: 191.09469
- Monoisotopic Mass: 191.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 197
- 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: 1.9
- Topological Polar Surface Area: 42.2?2
Experimental Properties
- PSA: 42.25
Butanenitrile, 4-(3-methoxyphenoxy)- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
651027-16-6 (Butanenitrile, 4-(3-methoxyphenoxy)-) Related Products
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