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Compound: 5546
Plants: 312
References: 992
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2-Undecenal
ScientificNameLabel
2-Undecenal
PHCD compound ID :
2118
Chemical Names :
(E)-2-undecenal , (E)-Undec-2-enal , 2-Undecenal
Molecular Formula :
C11H20O1
Molecular Weight :
168.151415
More Details :
Names & Synonyms:
(E)-undec-2-enal , (E)-2-undecenal
Smiles:
CCCCCCCC/C=C/C=O
InChi :
InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h9-11H,2-8H2,1H3/b10-9+
InChi Key :
InChIKey=PANBRUWVURLWGY-MDZDMXLPSA-N
PubChem ID :
5283356
Rotatable bond count :
8
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
10.111266
Hydrogen bond donor count :
0
Electric dipole moment :
4.275
XLogP :
4.695
VDW volume :
202.329599
Molecular weight :
168.151415
HOMO-LUMO gap :
9.801000
Herb list :
Red pepper - Capsicum annuum - فلفل قرمز
Sumac - Rhus coriaria - سماق
Tamarind, Indian date - Tamarindus indica - تمرهندی
Refrences & Litretures:
251. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'318' DOI:'10.1080/10412905.2004.9698731' Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'
444. Journal:'FLAVOUR AND FRAGRANCE JOURNAL' Year:'1993' Volume:'8' Page:'209' DOI:'10.1002/ffj.2730080408' Title:'The Essential Oil of Rhus coriaria L. Fruits'
546. Journal:'Food Chemistry' Year:'2007' Volume:'102' Page:'1096' DOI:'10.1016/j.foodchem.2006.06.047' Title:'Chemical and biological variability of hot pepper fruits (Capsicum annuum var. acuminatum L.) in relation to maturity stage'
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