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1,2,4-Metheno,1H-indene
PHCD compound ID : 1224
Chemical Names :
1,2,4-Metheno,1H-indene
Molecular Formula : C10H6
Molecular Weight : 126.04695
More Details :
Names & Synonyms:
Smiles: c1cc2c3c(c1)[C@H]1[C@@H]2C1=C3
InChi : InChI=1S/C10H6/c1-2-5-7-4-8-9(5)10(8)6(7)3-1/h1-4,9-10H/t9-,10+
InChi Key : InChIKey=ZKOZJNMUXZLEPP-AOOOYVTPSA-N
PubChem ID : 91749855
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.771438
Hydrogen bond donor count : 0 Electric dipole moment : 2.739
XLogP : 1.819 VDW volume : 110.644635
Molecular weight : 126.04695 HOMO-LUMO gap : 7.166000
Herb list :
Refrences & Litretures:
  
126.      Journal:'Chemistry of Natural Compounds'      Year:'2005'      Volume:'41'      Page:'311'      DOI:''      Title:'Ferula gummosa FRUITS: AN AROMATIC ANTIMICROBIAL AGENT'
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