B74
Summary
| Name: | (3-methylphenyl)methanol |
| Formula: | C8 H10 O |
| Formal charge: | 0 |
| Formula weight: | 122.164 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3-methylphenyl)methanol |
| OpenEye OEToolkits | 2.0.6 | (3-methylphenyl)methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(O)c1cc(ccc1)C |
| InChI | InChI | 1.03 | InChI=1S/C8H10O/c1-7-3-2-4-8(5-7)6-9/h2-5,9H,6H2,1H3 |
| InChIKey | InChI | 1.03 | JJCKHVUTVOPLBV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(CO)c1 |
| SMILES | CACTVS | 3.385 | Cc1cccc(CO)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CO |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CO |
