P6S
Summary
| Name: | benzyl hydrogen carbonate |
| Formula: | C8 H8 O3 |
| Formal charge: | 0 |
| Formula weight: | 152.147 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | benzyl hydrogen carbonate |
| OpenEye OEToolkits | 2.0.7 | (phenylmethyl) hydrogen carbonate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(OC(=O)O)c1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C8H8O3/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10) |
| InChIKey | InChI | 1.03 | NJAPCAIWQRPQPY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)OCc1ccccc1 |
| SMILES | CACTVS | 3.385 | OC(=O)OCc1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)COC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)COC(=O)O |
