Cas no 52856-54-9 (Benzoic acid,dihydroxy-, copper salt (9CI))
52856-54-9 structure
Product Name:Benzoic acid,dihydroxy-, copper salt (9CI)
CAS No:52856-54-9
MF:C7H5CuO4
MW:216.658203840256
CID:368938
PubChem ID:112500438
Update Time:2025-04-19
Benzoic acid,dihydroxy-, copper salt (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,dihydroxy-, copper salt (9CI)
- copper dihydroxybenzoate
- copper,2-carboxy-6-hydroxyphenolate
- benzoate, 2,3-dihydroxy-, copper(2+) salt (1:1)
- copper(2+) bis(2,3-dihydroxybenzoate)
- 52856-54-9
- EINECS 258-224-1
-
- Inchi： 1S/C7H6O4.Cu/c8-5-3-1-2-4(6(5)9)7(10)11;/h1-3,8-9H,(H,10,11);/p-1
- InChI Key： YBGDZLOQBFOMHE-UHFFFAOYSA-M
- SMILES： [Cu].OC1=CC=CC(C(=O)O)=C1[O-]
Computed Properties
- Exact Mass: 368.9671
- Monoisotopic Mass: 215.948385
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 157
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 5
- XLogP3: nothing
- Topological Polar Surface Area: 80.6
Experimental Properties
- Boiling Point: 362.5°Cat760mmHg
- Flash Point: 187.2°C
- PSA: 161.18
Benzoic acid,dihydroxy-, copper salt (9CI) Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
52856-54-9 (Benzoic acid,dihydroxy-, copper salt (9CI)) Related Products
- 490-79-9(2,5-Dihydroxybenzoic acid)
- 303-38-8(2,3-Dihydroxybenzoic acid)
- 610-02-6(2,3,4-Trihydroxybenzoic acid)
- 610-92-4(DHTA)
- 294661-02-2(2,5-Dihydroxybenzoic Acid-d3 (d2 Major))
- 50-85-1(4-Methylsalicylic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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