Cas no 62379-59-3 (Benzoic acid, methylenebis[4-hydroxy-)
62379-59-3 structure
Product Name:Benzoic acid, methylenebis[4-hydroxy-
CAS No:62379-59-3
MF:C15H12O6
MW:288.252184867859
CID:447114
PubChem ID:53899446
Update Time:2025-04-19
Benzoic acid, methylenebis[4-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 2-[(2-carboxy-5-hydroxyphenyl)methyl]-4-hydroxybenzoic acid
- 62379-59-3
- DTXSID40707501
- 2,2'-Methylenebis(4-hydroxybenzoic acid)
- Benzoic acid, methylenebis[4-hydroxy-
-
- Inchi： 1S/C15H12O6/c16-10-1-3-12(14(18)19)8(6-10)5-9-7-11(17)2-4-13(9)15(20)21/h1-4,6-7,16-17H,5H2,(H,18,19)(H,20,21)
- InChI Key： HWBOPRGVRAEEKO-UHFFFAOYSA-N
- SMILES： OC1C=CC(C(=O)O)=C(C=1)CC1C=C(C=CC=1C(=O)O)O
Computed Properties
- Exact Mass: 288.06336
- Monoisotopic Mass: 288.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 360
- 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: 2.2
- Topological Polar Surface Area: 115?2
Experimental Properties
- PSA: 115.06
Benzoic acid, methylenebis[4-hydroxy- Related Literature
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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