Cas no 89346-89-4 (1,3-Benzodioxole, 5-(3-methoxyphenyl)-)
89346-89-4 structure
Product Name:1,3-Benzodioxole, 5-(3-methoxyphenyl)-
CAS No:89346-89-4
MF:C14H12O3
MW:228.243284225464
CID:603546
PubChem ID:54432059
Update Time:2025-04-19
1,3-Benzodioxole, 5-(3-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzodioxole, 5-(3-methoxyphenyl)-
- 5-(3-methoxyphenyl)-1,3-benzodioxole
- DTXSID10711276
- 5-(3-Methoxyphenyl)-2H-1,3-benzodioxole
- 89346-89-4
-
- Inchi： 1S/C14H12O3/c1-15-12-4-2-3-10(7-12)11-5-6-13-14(8-11)17-9-16-13/h2-8H,9H2,1H3
- InChI Key： BINNDGSXZVLFDD-UHFFFAOYSA-N
- SMILES： O1COC2C=CC(=CC1=2)C1C=CC=C(C=1)OC
Computed Properties
- Exact Mass: 228.079
- Monoisotopic Mass: 228.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 256
- 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: 27.7A^2
- XLogP3: 3.3
1,3-Benzodioxole, 5-(3-methoxyphenyl)- Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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3. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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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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