XBZ
Summary
Name: | 1,2,4-trimethylbenzene |
Formula: | C9 H12 |
Formal charge: | 0 |
Formula weight: | 120.192 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1,2,4-trimethylbenzene |
OpenEye OEToolkits | 1.7.6 | 1,2,4-trimethylbenzene |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1c(ccc(c1C)C)C |
InChI | InChI | 1.03 | InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3 |
InChIKey | InChI | 1.03 | GWHJZXXIDMPWGX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(C)c(C)c1 |
SMILES | CACTVS | 3.385 | Cc1ccc(C)c(C)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(c1)C)C |
SMILES | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(c1)C)C |