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 >
Crypton
ScientificNameLabel
Crypton
PHCD compound ID :
144
Chemical Names :
cryptone , 2-Cyclohexen-1-one.4-(1-methylethyl)- , Crypton
Molecular Formula :
C9H14O1
Molecular Weight :
138.104465
More Details :
Names & Synonyms:
4-isopropylcyclohex-2-en-1-one , 4-propan-2-yl-1-cyclohex-2-enone , 4-propan-2-ylcyclohex-2-en-1-one
Smiles:
CC([C@H]1CCC(=O)C=C1)C
InChi :
InChI=1S/C9H14O/c1-7(2)8-3-5-9(10)6-4-8/h3,5,7-8H,4,6H2,1-2H3/t8-/m1/s1
InChi Key :
InChIKey=AANMVENRNJYEMK-MRVPVSSYSA-N
PubChem ID :
92780
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.899117
Hydrogen bond donor count :
0
Electric dipole moment :
4.493
XLogP :
2.387
VDW volume :
155.381171
Molecular weight :
138.104465
HOMO-LUMO gap :
9.782000
Herb list :
- Echinophora sibthorpiana - خوشاویزه، خوشاریزه
Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا
Black pepper - Piper nigrum - فلفل سیاه
Blue gum - Eucalyptus globulus - اکالیپتوس
Chaste tree , Vitex - Vitex agnus-castus - پنج انگشت، فلفل بری
Cubeb pepper, Cubeb - Piper cubeba - کبابه، کبابه چینی
Eucalyptus, River red gum - Eucalyptus camaldulensis - اكاليپتوس
Fennel - Foeniculum vulgare - رازیانه
Lavender - Lavandula angustifolia - اسطوخودوس
Licorice, Liquorice - Glycyrrhiza glabra - شیرین بیان
Myrtle - Myrtus communis - مورد
Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش
Parsley - Petroselinum crispum (Miller) A.W.Hill - جعفری
True lavender - Lavandula officinalis - اسطوخودوس
Turpentine tree - Pistacia terebinthus - پسته کوهی
Refrences & Litretures:
8. Journal:'Rev Bras Farmacogn' Year:'2013' Volume:'23' Page:'877' DOI:'' Title:'Chemical composition, antischistosomal and cytotoxic effects of the essential oil of Lavandula angustifolia grown in Southeastern Brazil'
10. Journal:'Journal of Chromatography A' Year:'2005' Volume:'1098' Page:'14' DOI:'10.1016/j.chroma.2005.08.054' Title:'Hydrodistillation-headspace solvent microextraction, a new method for analysis of the essential oil components of Lavandula angustifolia Mill'
22. Journal:'Z Lebensm Unters Forsch A' Year:'1999' Volume:'208' Page:'212' DOI:'' Title:'Effect of extraction techniques on the chemical composition and antioxidant activity of Eucalyptus camaldulensis var. brevirostris leaf oils'
23. Journal:'J. Essent. Oil Res' Year:'2000' Volume:'12' Page:'333' DOI:'10.1080/10412905.2000.9699530' Title:'Essential Oil Composition of Eucalyptus camaldulensis Dehn. from Mozambique'
203. Journal:'Food Chemistry' Year:'2011' Volume:'128' Page:'1017' DOI:'10.1016/j.foodchem.2011.04.007' Title:'Chemical composition and antimicrobial activity of Vitex agnus-castus L. fruits and leaves essential oils'
281. Journal:'J. Bio. Env. Sci' Year:'2016' Volume:'8' Page:'240' DOI:'' Title:'Essential oil variation within and between Stachys inflata Benth. and Stachys lavandulifolia Vahl. populations from Iran'
284. Journal:'International Journal of Pharmacognosy and Phytochemical Research' Year:'2015' Volume:'7' Page:'673' DOI:'' Title:'Chemical Composition of Essential Oil of Stachys lavandulifolia Vahl. From Iran'
353. Journal:'Portugaliae Electrochimica Acta' Year:'2011' Volume:'29' Page:'127' DOI:'10.4152/pea.201102127' Title:'Fennel (Foeniculum Vulgare) Essential Oil as Green Corrosion Inhibitor of Carbon Steel in Hydrochloric Acid Solution'
513. Journal:'J. of Supercritical Fluids' Year:'2014' Volume:'95' Page:'373' DOI:'10.1016/j.sup?u.2014.08.009' Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
539. Journal:'J. Med. Plants Res' Year:'2013' Volume:'7' Page:'2349' DOI:'10.5897/JMPR2013.4493' Title:'Correlation between chemical profiles of black pepper (Piper nigrum L.) var. Panniyur-1 collected from different locations'
577. Journal:'J. Essent. Oil Res' Year:'2007' Volume:'19' Page:'14' DOI:'10.1080/10412905.2007.9699217' Title:'Essential Oil Constituents of Piper cubeba L. fils. from Indonesia'
678. Journal:'Molecules' Year:'2013' Volume:'18' Page:'14948' DOI:'10.3390/molecules181214948' Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
701. Journal:'Molecules' Year:'2010' Volume:'15' Page:'2759' DOI:'10.3390/molecules15042759' Title:'Essential Oil of Myrtus communis L. as a Potential Antioxidant and Antimutagenic Agents'
760. Journal:'International Journal of ChemTech Research' Year:'2014' Volume:'6' Page:'4918' DOI:'' Title:'Chemical composition and fungitoxic activities of Lavandula officinalis L. oil and comparison with synthetic fungicide on the growth some fungi in vitro'
847. Journal:'ORIENTAL JOURNAL OF CHEMISTRY' Year:'2016' Volume:'32' Page:'331' DOI:'10.13005/ojc/320137' Title:'A Comparative Study of the Chemical Composition of the Essential oil from Eucalyptus globulus Growing in Dehradun (india) and Around the World'
851. Journal:'J. Essent. Oil Res' Year:'1995' Volume:'7' Page:'147' DOI:'10.1080/10412905.1995.9698489' Title:'Chemical Composition of Eucalyptus globulus Oils from the Montenegro Coast and East Coast of Spain'
883. Journal:'Pharmaceutical Biology' Year:'2004' Volume:'42' Page:'360' DOI:'10.1080/13880200490519677' Title:'Chemical Composition of Essential Oils from Leaves and Twigs of Pistacia lentiscus, Pistacia lentiscus var. chia, and Pistacia terebinthus from Turkey'
902. Journal:'Rec. Nat. Prod' Year:'2010' Volume:'4' Page:'167' DOI:'' Title:'Chemical composition of Echinophora tenuifolia subsp. sibthorpiana essential oil from Greece'
929. Journal:'Microbial Pathogenesis' Year:'2016' Volume:'90' Page:'13' DOI:'10.1016/j.micpath.2015.11.004' Title:'Chemical composition and antibio?lm activity of Petroselinum crispum and Ocimum basilicum essential oils against Vibrio spp. strains'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us