Cas no 67370-96-1 (Benzoic acid, 2-hydroxy-5-methoxy-4-(phenylmethoxy)-)
67370-96-1 structure
Product Name:Benzoic acid, 2-hydroxy-5-methoxy-4-(phenylmethoxy)-
CAS No:67370-96-1
MF:C15H14O5
MW:274.268664836884
CID:1722564
PubChem ID:71374855
Update Time:2025-04-21
Benzoic acid, 2-hydroxy-5-methoxy-4-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-hydroxy-5-methoxy-4-(phenylmethoxy)-
- 2-hydroxy-5-methoxy-4-phenylmethoxybenzoic acid
- DTXSID10797616
- 67370-96-1
- 4-(Benzyloxy)-2-hydroxy-5-methoxybenzoic acid
-
- Inchi： 1S/C15H14O5/c1-19-13-7-11(15(17)18)12(16)8-14(13)20-9-10-5-3-2-4-6-10/h2-8,16H,9H2,1H3,(H,17,18)
- InChI Key： ZEXTYMBSIVWUNJ-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1C=C(C(C(=O)O)=CC=1OC)O
Computed Properties
- Exact Mass: 274.08412
- Monoisotopic Mass: 274.08412354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 313
- 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: 3.1
- Topological Polar Surface Area: 76?2
Experimental Properties
- PSA: 75.99
Benzoic acid, 2-hydroxy-5-methoxy-4-(phenylmethoxy)- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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