Cas no 183874-21-7 (3-Methoxy-2-(phenyl methyl) benzoic acid)
183874-21-7 structure
Product Name:3-Methoxy-2-(phenyl methyl) benzoic acid
CAS No:183874-21-7
MF:C15H14O3
MW:242.269864559174
CID:2195254
PubChem ID:15258650
Update Time:2025-04-21
3-Methoxy-2-(phenyl methyl) benzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-Methoxy-2-(phenyl methyl) benzoic acid
- 2-benzyl-3-methoxybenzoic acid
- SCHEMBL6307911
- 183874-21-7
- IFMZQWXUSIZGHE-UHFFFAOYSA-N
- 2-benzyl-3-methoxy-benzoic acid
- DB-348362
-
- Inchi: 1S/C15H14O3/c1-18-14-9-5-8-12(15(16)17)13(14)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,16,17)
- InChI Key: IFMZQWXUSIZGHE-UHFFFAOYSA-N
- SMILES: O(C)C1=CC=CC(C(=O)O)=C1CC1C=CC=CC=1
Computed Properties
- Exact Mass: 242.094294304Da
- Monoisotopic Mass: 242.094294304Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 271
- 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: 3.3
- Topological Polar Surface Area: 46.5?2
3-Methoxy-2-(phenyl methyl) benzoic acid Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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