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: 49
About
About PHCD
The Team
Sponsors
Publications
Citing
Contact Us
Sign in >
1-tetratriacontanol
ScientificNameLabel
1-tetratriacontanol
PHCD compound ID :
1378
Chemical Names :
1-tetratriacontanol
Molecular Formula :
C34H70O1
Molecular Weight :
494.542667
More Details :
Names & Synonyms:
tetratriacontan-1-ol , 1-tetratriacontanol
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO
InChi :
InChI=1S/C34H70O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35/h35H,2-34H2,1H3
InChi Key :
InChIKey=OULAJFUGPPVRBK-UHFFFAOYSA-N
PubChem ID :
185639
Rotatable bond count :
32
Rule of five :
2
Hydrogen bond acceptor count :
1
Ionization potential :
10.402577
Hydrogen bond donor count :
1
Electric dipole moment :
2.173
XLogP :
17.921
VDW volume :
605.410163
Molecular weight :
494.542667
HOMO-LUMO gap :
13.523000
Herb list :
Rice - Oryza sativa - برنج
Refrences & Litretures:
146. Journal:'Phytochem. Anal' Year:'2006' Volume:'17' Page:'36' DOI:'10.1002/pca.879' Title:'Chemical Constituents of Rice (Oryza sativa) Hulls and their Herbicidal Activity against Duckweed (Lemna paucicostata Hegelm 381)'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us