Cas no 94159-26-9 (3-Methoxyphenyl o-acetylsalicylate)
94159-26-9 structure
Product Name:3-Methoxyphenyl o-acetylsalicylate
CAS No:94159-26-9
MF:C16H14O5
MW:286.279365062714
CID:818547
PubChem ID:11971304
Update Time:2025-04-19
3-Methoxyphenyl o-acetylsalicylate Chemical and Physical Properties
Names and Identifiers
-
- 3-Methoxyphenyl o-acetylsalicylate
- EINECS 303-204-0
- NS00065535
- 3-METHOXYPHENYL 2-(ACETYLOXY)BENZOATE
- 94159-26-9
- DTXSID10916244
-
- Inchi： 1S/C16H14O5/c1-11(17)20-15-9-4-3-8-14(15)16(18)21-13-7-5-6-12(10-13)19-2/h3-10H,1-2H3
- InChI Key： NEPVYKZQDZUSFC-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1OC(C)=O)=O)C1C=CC=C(C=1)OC
Computed Properties
- Exact Mass: 287.091949
- Monoisotopic Mass: 287.091949
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 333
- 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: 65
- XLogP3: 2.9
Experimental Properties
- Density: 1.22
- Boiling Point: 434.3°Cat760mmHg
- Flash Point: 193.2°C
- Refractive Index: 1.561
3-Methoxyphenyl o-acetylsalicylate Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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4. 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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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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