SEZ
Summary
Name: | 1,3,5-trimethylbenzene |
Synonyms: | mesitylene |
Formula: | C9 H12 |
Formal charge: | 0 |
Formula weight: | 120.192 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 1,3,5-trimethylbenzene |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H12/c1-7-4-8(2)6-9(3)5-7/h4-6H,1-3H3 |
InChIKey | InChI | 1.03 | AUHZEENZYGFFBQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(C)cc(C)c1 |
SMILES | CACTVS | 3.385 | Cc1cc(C)cc(C)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)C)C |