Cas no 870959-66-3 (Benzoic acid, 3-methoxy-4-(2-methoxyethoxy)-, methyl ester)
870959-66-3 structure
Product Name:Benzoic acid, 3-methoxy-4-(2-methoxyethoxy)-, methyl ester
CAS No:870959-66-3
MF:C12H16O5
MW:240.252444267273
CID:1870047
PubChem ID:60351193
Update Time:2025-04-21
Benzoic acid, 3-methoxy-4-(2-methoxyethoxy)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3-methoxy-4-(2-methoxyethoxy)-, methyl ester
- 870959-66-3
- 3-Methoxy-4-(2-methoxy-ethoxy)-benzoic acid methyl ester
- SCHEMBL1015775
- AKOS008318057
- NAAAVUWIVOQLPG-UHFFFAOYSA-N
- DB-187925
- methyl 3-methoxy-4-(2-methoxyethoxyl)benzoate
- methyl 3-methoxy-4-(2-methoxyethoxy)benzoate
-
- Inchi： 1S/C12H16O5/c1-14-6-7-17-10-5-4-9(12(13)16-3)8-11(10)15-2/h4-5,8H,6-7H2,1-3H3
- InChI Key： NAAAVUWIVOQLPG-UHFFFAOYSA-N
- SMILES： O(CCOC)C1C=CC(C(=O)OC)=CC=1OC
Computed Properties
- Exact Mass: 240.09977361Da
- Monoisotopic Mass: 240.09977361Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 231
- 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: 1.8
- Topological Polar Surface Area: 54?2
Benzoic acid, 3-methoxy-4-(2-methoxyethoxy)-, methyl ester Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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