Octacosanal

ScientificNameLabel

Octacosanal
PHCD compound ID :	930
Chemical Names :	Octacosanal
Molecular Formula :	C28H56O1
Molecular Weight :	408.433116

More Details :

Names & Synonyms:	octacosanal , montanaldehyde
Smiles:	CCCCCCCCCCCCCCCCCCCCCCCCCCCC=O
InChi :	InChI=1S/C28H56O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29/h28H,2-27H2,1H3
InChi Key :	InChIKey=LVXORIXZNUNHGQ-UHFFFAOYSA-N
PubChem ID :	3084376

Rotatable bond count :	26	Rule of five :	2
Hydrogen bond acceptor count :	1	Ionization potential :	10.136234
Hydrogen bond donor count :	0	Electric dipole moment :	2.867
XLogP :	14.812	VDW volume :	498.997796
Molecular weight :	408.433116	HOMO-LUMO gap :	10.866000

Herb list :

Thyme, Garden thyme - Thymus vulgaris - آويشن باغی

Refrences & Litretures:


74. Journal:'Food Chemistry' Year:'1998' Volume:'63' Page:'373' DOI:'' Title:'Study of the composition of the different parts of a Spanish Thymes vulgaris L. plant'

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