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ScientificNameLabel
1-cyclohexene-1-carboxaldehyde
PHCD compound ID : 5420
Chemical Names :
1-cyclohexene-1-carboxaldehyde
Molecular Formula : C7H10O1
Molecular Weight : 110.073165
More Details :
Names & Synonyms: cyclohexene-1-carbaldehyde , 1-cyclohexenecarboxaldehyde
Smiles: O=CC1=CCCCC1
InChi : InChI=1S/C7H10O/c8-6-7-4-2-1-3-5-7/h4,6H,1-3,5H2
InChi Key : InChIKey=OANSOJSBHVENEI-UHFFFAOYSA-N
PubChem ID : 5184540
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.945314
Hydrogen bond donor count : 0 Electric dipole moment : 3.491
XLogP : 1.586 VDW volume : 120.789202
Molecular weight : 110.073165 HOMO-LUMO gap : 9.772000
Herb list :
Refrences & Litretures:
  
897.      Journal:'Journal of Medicinal Plants and By-products'      Year:'2016'      Volume:'2'      Page:'159'      DOI:''      Title:'Essential Oils of Salvia hydrangea DC. ex Benth. from Kiasar-Hezarjarib regions, Iran-Impact of eEnvironmental Factors as Quality Determinants'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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