Home
News
Search
Basic
Structure
Physicochemical properties
Topological properties
Services
Virtual Screening
Docking
Chemoinformatics
Training
Help
Data Description
Version History
FAQ
Your Comments
Data Submission
Statistics
Compound: 5546
Plants: 312
References: 992
Visitors: 5
About
About PHCD
The Team
Sponsors
Publications
Citing
Contact Us
Sign in >
Cyclotetracosane
ScientificNameLabel
Cyclotetracosane
PHCD compound ID :
3997
Chemical Names :
Cyclotetracosane
Molecular Formula :
C24H48
Molecular Weight :
336.375602
More Details :
Names & Synonyms:
cyclotetracosane
Smiles:
C1CCCCCCCCCCCCCCCCCCCCCCC1
InChi :
InChI=1S/C24H48/c1-2-4-6-8-10-12-14-16-18-20-22-24-23-21-19-17-15-13-11-9-7-5-3-1/h1-24H2
InChi Key :
InChIKey=OOTMSKDHDITFHF-UHFFFAOYSA-N
PubChem ID :
520449
Rotatable bond count :
0
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
10.641631
Hydrogen bond donor count :
0
Electric dipole moment :
0.038
XLogP :
13.656
VDW volume :
411.303631
Molecular weight :
336.375602
HOMO-LUMO gap :
14.558000
Herb list :
Red pepper - Capsicum annuum - فلفل قرمز
Refrences & Litretures:
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us