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ScientificNameLabel
butyric acid
PHCD compound ID : 669
Chemical Names :
butyric acid , Butanoic acid , Butanoic-acid
Molecular Formula : C4H8O2
Molecular Weight : 88.052429
More Details :
Names & Synonyms: butyric acid , butanoic acid
Smiles: CCCC(=O)O
InChi : InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)
InChi Key : InChIKey=FERIUCNNQQJTOY-UHFFFAOYSA-N
PubChem ID : 264
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 11.182926
Hydrogen bond donor count : 1 Electric dipole moment : 1.954
XLogP : 0.742 VDW volume : 92.684392
Molecular weight : 88.052429 HOMO-LUMO gap : 12.123000
Herb list :
Refrences & Litretures:
  
40.      Journal:'J. Agric. Food Chem'      Year:'2003'      Volume:'51'      Page:'5408'      DOI:'10.1021/jf030087i'      Title:'Aroma Composition of Vitis vinifera Cv. Tannat: the Typical Red Wine from Uruguay'
71.      Journal:'Food Chemistry'      Year:'2005'      Volume:'91'      Page:'131'      DOI:'10.1016/j.foodchem.2004.05.056'      Title:'Identi?cation of volatile components in basil (Ocimum basilicum L.) and thyme leaves (Thymus vulgaris L.) and their antioxidant properties'
219.      Journal:'Intl J Agri Crop Sci'      Year:'2013'      Volume:'5'      Page:'1946'      DOI:''      Title:'Chemical analysis and Identification of the components of two ecotypes of (Mentha Longifolia L. ( in Iran province'
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
263.      Journal:'Z Lebensm Unters Forsch A'      Year:'1997'      Volume:'205'      Page:'218'      DOI:''      Title:'Analysis of strawberry flavour - discrimination of aroma types by quantification of volatile compounds'
355.      Journal:'Iranian Journal of Fisheries Sciences'      Year:'2013'      Volume:'12'      Page:'702'      DOI:''      Title:'Evaluation of the chemical composition and in vitro antimicrobial activity of Rosmarinus officinalis, Zataria multiflora, Anethum graveolens and Eucalyptus globulus against Streptococcus iniae; the cause of zoonotic disease in farmed fish'
550.      Journal:'Biosci., Biotech. Res. Asia'      Year:'2015'      Volume:'12'      Page:'2053'      DOI:'10.13005/bbra/1873'      Title:'Chemical Composition of Native Hazelnut (Corylus avellana L.) Varieties in Iran, Association with Ecological Conditions'
567.      Journal:'Food Research International'      Year:'2011'      Volume:'44'      Page:'250'      DOI:'10.1016/j.foodres.2010.10.028'      Title:'Dynamics of volatile and non-volatile compounds in cocoa (Theobroma cacao L.) during fermentation and drying processes using principal components analysis'
752.      Journal:'Journal of Essential Oil Research'      Year:'2011'      Volume:'22'      Page:'483'      DOI:'org/10.1080/10412905.2010.9700377'      Title:'Volatile Constituents in Dried Roots of Isatis tinctorial L. (Brassicaceae)'
760.      Journal:'International Journal of ChemTech Research'      Year:'2014'      Volume:'6'      Page:'4918'      DOI:''      Title:'Chemical composition and fungitoxic activities of Lavandula officinalis L. oil and comparison with synthetic fungicide on the growth some fungi in vitro'
901.      Journal:'Journal of Advanced Research'      Year:'2017'      Volume:'8'      Page:'379'      DOI:'10.1016/j.jare.2017.05.002'      Title:'Volatiles pro?ling in Ceratonia siliqua (Carob bean) from Egypt and in response to roasting as analyzed via solid-phase microextraction coupled to chemometrics'
950.      Journal:'International Journal of Unani and Integrative Medicine 2017; 1(2): 04'      Year:'2017'      Volume:'1'      Page:'4'      DOI:''      Title:'Bisfayej (Polypodium vulgare L.): A review on medicinal importance of rhizome with Unani prospective and modern pharmacology'
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