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Compound: 5546
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References: 992
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Methyl-(1-propenyl)-disulfideb
ScientificNameLabel
Methyl-(1-propenyl)-disulfideb
PHCD compound ID :
3382
Chemical Names :
trans-Propenyl methyl disulfide , Methyl-(1-propenyl)-disulfideb
Molecular Formula :
C4H8S2
Molecular Weight :
120.006742
More Details :
Names & Synonyms:
(E)-1-(methyldisulfanyl)prop-1-ene , (E)-1-(methyldisulfanyl)-1-propene
Smiles:
CSS/C=C/C
InChi :
InChI=1S/C4H8S2/c1-3-4-6-5-2/h3-4H,1-2H3/b4-3+
InChi Key :
InChIKey=FUDUFCLRGSEHAJ-ONEGZZNKSA-N
PubChem ID :
5366552
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
8.655406
Hydrogen bond donor count :
0
Electric dipole moment :
3.119
XLogP :
2.237
VDW volume :
112.121987
Molecular weight :
120.006742
HOMO-LUMO gap :
7.841000
Herb list :
Garlic - Allium sativum - سیر
Refrences & Litretures:
466. Journal:'Journal of Essential Oil Research' Year:'2014' Volume:'26' Page:'91' DOI:'10.1080/10412905.2013.868329' Title:'Composition of garlic essential oil (Allium sativum L.) as influenced by drying method'
470. Journal:'J Food Sci' Year:'2012' Volume:'77' Page:'M278' DOI:'10.1111/j.1750-3841.2012.02662.x' Title:'Effects of Onion (Allium cepa L.) and Garlic (Allium sativum L.) Essential Oils on the Aspergillus versicolor Growth and Sterigmatocystin Production'
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