FEH
Summary
Name: | (1R)-1-phenylethane-1,2-diol |
Formula: | C8 H10 O2 |
Formal charge: | 0 |
Formula weight: | 138.164 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (1R)-1-phenylethane-1,2-diol |
OpenEye OEToolkits | 1.7.6 | (1R)-1-phenylethane-1,2-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC(c1ccccc1)CO |
InChI | InChI | 1.03 | InChI=1S/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H2/t8-/m0/s1 |
InChIKey | InChI | 1.03 | PWMWNFMRSKOCEY-QMMMGPOBSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC[C@H](O)c1ccccc1 |
SMILES | CACTVS | 3.385 | OC[CH](O)c1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)[C@H](CO)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C(CO)O |