Cas no 1148146-86-4 (5-(4-Chlorobenzyloxy)-2-methylbenzoic acid)
1148146-86-4 structure
Product Name:5-(4-Chlorobenzyloxy)-2-methylbenzoic acid
CAS No:1148146-86-4
MF:C15H13ClO3
MW:276.714923620224
CID:2114654
Update Time:2023-08-04
5-(4-Chlorobenzyloxy)-2-methylbenzoic acid Chemical and Physical Properties
Names and Identifiers
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- 5-(4-chlorobenzyloxy)-2-methylbenzoic acid
- 5-(4-Chlorobenzyloxy)-2-methylbenzoic acid
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- Inchi： 1S/C15H13ClO3/c1-10-2-7-13(8-14(10)15(17)18)19-9-11-3-5-12(16)6-4-11/h2-8H,9H2,1H3,(H,17,18)
- InChI Key： LGWJKPVOEWYCEJ-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)COC1C=CC(C)=C(C(=O)O)C=1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 300
- Topological Polar Surface Area: 46.5
5-(4-Chlorobenzyloxy)-2-methylbenzoic acid Related Literature
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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