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1,2,3-Propanetriol,1-acetate
PHCD compound ID : 4410
Chemical Names :
1,2,3-Propanetriol,1-acetate
Molecular Formula : C5H10O4
Molecular Weight : 134.057909
More Details :
Names & Synonyms: 2,3-dihydroxypropyl acetate , acetic acid 2,3-dihydroxypropyl ester , 2,3-bis(oxidanyl)propyl ethanoate , acetic acid glyceryl ester
Smiles: CC(=O)OC[C@H](CO)O
InChi : InChI=1S/C5H10O4/c1-4(7)9-3-5(8)2-6/h5-6,8H,2-3H2,1H3/t5-/m0/s1
InChi Key : InChIKey=KMZHZAAOEWVPSE-YFKPBYRVSA-N
PubChem ID : 33510
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 10.505183
Hydrogen bond donor count : 2 Electric dipole moment : 2.764
XLogP : -1.14 VDW volume : 127.56083
Molecular weight : 134.057909 HOMO-LUMO gap : 11.236000
Herb list :
Refrences & Litretures:
  
656.      Journal:'Int. J. LifeSc. Bt & Pharm. Res'      Year:'2012'      Volume:'1'      Page:'164'      DOI:''      Title:'ANTIBACTERIAL ACTIVITY OF PUNICA GRANATUM PEEL EXTRACTS AGAINST SHIGA TOXIN PRODUCING E. COLI'
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