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m-xylene
ScientificNameLabel
m-xylene
PHCD compound ID :
2518
Chemical Names :
m-xylene
Molecular Formula :
C8H10
Molecular Weight :
106.07825
More Details :
Names & Synonyms:
m-xylene , 1,3-xylene , 1,3-dimethylbenzene
Smiles:
Cc1cccc(c1)C
InChi :
InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3
InChi Key :
InChIKey=IVSZLXZYQVIEFR-UHFFFAOYSA-N
PubChem ID :
7929
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.237861
Hydrogen bond donor count :
0
Electric dipole moment :
0.657
XLogP :
2.866
VDW volume :
115.758501
Molecular weight :
106.07825
HOMO-LUMO gap :
9.659000
Herb list :
Henna - Lawsonia inermis - حنا
Refrences & Litretures:
290. Journal:'Journal of Essential Oil Research' Year:'1995' Volume:'7' Page:'425' DOI:'10.1080/10412905.1995.9698554' Title:'Volatile Components of Lawsonia inermis L. Flowers'
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