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ScientificNameLabel
Methyl-pentadecanonic
PHCD compound ID : 2076
Chemical Names :
Methyl-pentadecanonic
Molecular Formula : C16H32O2
Molecular Weight : 256.24023
More Details :
Names & Synonyms: 2-methylpentadecanoic acid
Smiles: CCCCCCCCCCCCC[C@H](C(=O)O)C
InChi : InChI=1S/C16H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16(17)18/h15H,3-14H2,1-2H3,(H,17,18)/t15-/m1/s1
InChi Key : InChIKey=XEFOHUNTIRSZAC-OAHLLOKOSA-N
PubChem ID : 91424
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.851995
Hydrogen bond donor count : 1 Electric dipole moment : 1.843
XLogP : 7.294 VDW volume : 300.236207
Molecular weight : 256.24023 HOMO-LUMO gap : 11.851000
Herb list :
Refrences & Litretures:
  
249.      Journal:'Pak. J. Bot'      Year:'2008'      Volume:'40'      Page:'2553'      DOI:''      Title:'CHEMICAL CONSTITUENTS OF TAMARINDUS INDICA L. MEDICINAL PLANT IN SINDH'
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