B0I
Summary
| Name: | 3,3'-dimethyl-1,1'-biphenyl |
| Formula: | C14 H14 |
| Formal charge: | 0 |
| Formula weight: | 182.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3,3'-dimethyl-1,1'-biphenyl |
| OpenEye OEToolkits | 2.0.6 | 1-methyl-3-(3-methylphenyl)benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc2cc(c1cc(C)ccc1)ccc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H14/c1-11-5-3-7-13(9-11)14-8-4-6-12(2)10-14/h3-10H,1-2H3 |
| InChIKey | InChI | 1.03 | GVEDOIATHPCYGS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(c1)c2cccc(C)c2 |
| SMILES | CACTVS | 3.385 | Cc1cccc(c1)c2cccc(C)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)c2cccc(c2)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)c2cccc(c2)C |
