SEZ

1,3,5-trimethylbenzene

Created:2020-11-13
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count21
Aromatic Bond Count6
2D diagram of SEZ

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Chemical Component Summary

Name1,3,5-trimethylbenzene
Synonymsmesitylene
Systematic Name (OpenEye OEToolkits)1,3,5-trimethylbenzene
FormulaC9 H12
Molecular Weight120.192
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385Cc1cc(C)cc(C)c1
SMILESOpenEye OEToolkits2.0.7Cc1cc(cc(c1)C)C
Canonical SMILESCACTVS3.385 Cc1cc(C)cc(C)c1
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1cc(cc(c1)C)C
InChIInChI1.03 InChI=1S/C9H12/c1-7-4-8(2)6-9(3)5-7/h4-6H,1-3H3
InChIKeyInChI1.03 AUHZEENZYGFFBQ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 7947
ChEMBL CHEMBL1797281
ChEBI CHEBI:34833
CCDC/CSD DICFUR, ERASOH, CUPJUS, ELIWUR, DEXLOH, EWUTIB, BONZUZ, AYEBEL, DIRVUW, ATEHOZ, AKUBUG