Cas no 911116-41-1 (Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy-)
911116-41-1 structure
Product Name:Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy-
CAS No:911116-41-1
MF:C12H16O5
MW:240.252444267273
CID:1967713
PubChem ID:23204556
Update Time:2025-04-21
Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy-
- SCHEMBL3371069
- 911116-41-1
- DB-104907
-
- Inchi： 1S/C12H16O5/c1-3-16-6-7-17-11-8-9(12(13)14)4-5-10(11)15-2/h4-5,8H,3,6-7H2,1-2H3,(H,13,14)
- InChI Key： WEZUMCYNVUOIIF-UHFFFAOYSA-N
- SMILES： O(C1C=C(C(=O)O)C=CC=1OC)CCOCC
Computed Properties
- Exact Mass: 240.09977361Da
- Monoisotopic Mass: 240.09977361Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- 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: 65?2
Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
911116-41-1 (Benzoic acid, 3-(2-ethoxyethoxy)-4-methoxy-) Related Products
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