Cas no 88086-66-2 (Benzoic acid, 2-(4-carboxyphenoxy)-5-chloro-)
88086-66-2 structure
Product Name:Benzoic acid, 2-(4-carboxyphenoxy)-5-chloro-
CAS No:88086-66-2
MF:C14H9ClO5
MW:292.671263456345
CID:645841
PubChem ID:71411028
Update Time:2025-04-19
Benzoic acid, 2-(4-carboxyphenoxy)-5-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-(4-carboxyphenoxy)-5-chloro-
- 2-(4-carboxyphenoxy)-5-chlorobenzoic acid
- DTXSID00830667
- 88086-66-2
-
- Inchi： 1S/C14H9ClO5/c15-9-3-6-12(11(7-9)14(18)19)20-10-4-1-8(2-5-10)13(16)17/h1-7H,(H,16,17)(H,18,19)
- InChI Key： HYCUKQHFKRIHJG-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C(=O)O)C=1)OC1C=CC(C(=O)O)=CC=1
Computed Properties
- Exact Mass: 292.0138511g/mol
- Monoisotopic Mass: 292.0138511g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 365
- 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: 83.8?2
Benzoic acid, 2-(4-carboxyphenoxy)-5-chloro- Related Literature
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Xinyi Liu,Huan Chen,Jing Lin,Yi Li,Liangqia Guo Chem. Commun., 2019,55, 2972-2975
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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