4T7
Summary
| Name: | (1R)-1-(naphthalen-2-yl)ethane-1,2-diol |
| Formula: | C12 H12 O2 |
| Formal charge: | 0 |
| Formula weight: | 188.222 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-1-(naphthalen-2-yl)ethane-1,2-diol |
| OpenEye OEToolkits | 1.9.2 | (1R)-1-naphthalen-2-ylethane-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(ccc2c1cccc2)C(CO)O |
| InChI | InChI | 1.03 | InChI=1S/C12H12O2/c13-8-12(14)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-14H,8H2/t12-/m0/s1 |
| InChIKey | InChI | 1.03 | QFNOPZNUHSDHKZ-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@H](O)c1ccc2ccccc2c1 |
| SMILES | CACTVS | 3.385 | OC[CH](O)c1ccc2ccccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc2cc(ccc2c1)[C@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc2cc(ccc2c1)C(CO)O |
