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ScientificNameLabel
3-Hydroxybenzoic acid
PHCD compound ID : 3732
Chemical Names :
3-Hydroxybenzoic acid , m-hydroxybenzoic acid
Molecular Formula : C7H6O3
Molecular Weight : 138.031694
More Details :
Names & Synonyms: 3-hydroxybenzoic acid , 3-oxidanylbenzoic acid
Smiles: Oc1cccc(c1)C(=O)O
InChi : InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)
InChi Key : InChIKey=IJFXRHURBJZNAO-UHFFFAOYSA-N
PubChem ID : 7420
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.596635
Hydrogen bond donor count : 2 Electric dipole moment : 3.477
XLogP : 0.268 VDW volume : 122.196738
Molecular weight : 138.031694 HOMO-LUMO gap : 8.712000
Herb list :
Refrences & Litretures:
  
513.      Journal:'J. of Supercritical Fluids'      Year:'2014'      Volume:'95'      Page:'373'      DOI:'10.1016/j.sup?u.2014.08.009'      Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
557.      Journal:'J. Agric. Food Chem'      Year:'2005'      Volume:'53'      Page:'8116'      DOI:'10.1021/jf058057y'      Title:'Separation, Characterization, and Quantitation of Phenolic Acids in a Little-Known Blueberry (Vaccinium arctostaphylos L.) Fruit by HPLC-MS'
970.      Journal:'Biocatalysis and Agricultural Biotechnology'      Year:'2019'      Volume:'19'      Page:'101163'      DOI:'10.1016/j.bcab.2019.101163'      Title:'Datura innoxia and Dipsacus laciniatus: Biological activity and phenolic composition'
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