Cas no 865305-55-1 (Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]-)
![Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]- structure](https://ossimg.kuujia.com/scimg/865500/865305-55-1x500.png)
865305-55-1 structure
Product Name:Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]-
CAS No:865305-55-1
MF:C13H15NO3
MW:233.263103723526
CID:718776
PubChem ID:45122029
Update Time:2025-04-19
Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]-
- 865305-55-1
- ACETONITRILE,2-[[2,3-DIHYDRO-5-(1-METHYLETHYL)-BENZO[B][1,4]DIOXINE-6-YL]OXY]-
- SCHEMBL5526681
-
- Inchi： 1S/C13H15NO3/c1-9(2)12-10(15-6-5-14)3-4-11-13(12)17-8-7-16-11/h3-4,9H,6-8H2,1-2H3
- InChI Key： LOWLPVJSJIJCEQ-UHFFFAOYSA-N
- SMILES： O1CCOC2C=CC(=C(C1=2)C(C)C)OCC#N
Computed Properties
- Exact Mass: 233.105
- Monoisotopic Mass: 233.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 296
- 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
- Topological Polar Surface Area: 51.5A^2
- XLogP3: 2.5
Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
865305-55-1 (Acetonitrile,2-[[2,3-dihydro-5-(1-methylethyl)-1,4-benzodioxin-6-yl]oxy]-) Related Products
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