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: 28
About
About PHCD
The Team
Sponsors
Publications
Citing
Contact Us
Sign in >
biphenyl
ScientificNameLabel
biphenyl
PHCD compound ID :
2806
Chemical Names :
biphenyl
Molecular Formula :
C12H10
Molecular Weight :
154.07825
More Details :
Names & Synonyms:
biphenyl , 1,1'-biphenyl
Smiles:
c1ccc(cc1)c1ccccc1
InChi :
InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H
InChi Key :
InChIKey=ZUOUZKKEUPVFJK-UHFFFAOYSA-N
PubChem ID :
7095
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.684259
Hydrogen bond donor count :
0
Electric dipole moment :
0.000
XLogP :
3.918
VDW volume :
153.776605
Molecular weight :
154.07825
HOMO-LUMO gap :
9.856000
Herb list :
Corn, Maize - Zea mays - ذرت، بلال
Red pepper - Capsicum annuum - فلفل قرمز
Refrences & Litretures:
339. Journal:'J. Agric. Food Chem' Year:'1978' Volume:'26' Page:'1290' DOI:'10.1021/jf60220a012' Title:'Volatile components of corn silk (Zea mays L.): possible Heliothis zea (Boddie) attractants'
544. Journal:'International Journal of Food Properties' Year:'2013' Volume:'16' Page:'18' DOI:'10.1080/10942912.2010.513616' Title:'Pakistani Bell Pepper (Capsicum annum L.): Chemical Compositions and its Antioxidant Activity'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us