EBP
Summary
| Name: | DIETHYL 4-METHYLBENZYLPHOSPHONATE |
| Formula: | C12 H19 O3 P |
| Formal charge: | 0 |
| Formula weight: | 242.251 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | diethyl (4-methylbenzyl)phosphonate |
| OpenEye OEToolkits | 1.5.0 | 1-(diethoxyphosphorylmethyl)-4-methyl-benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(OCC)(OCC)Cc1ccc(cc1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCO[P](=O)(Cc1ccc(C)cc1)OCC |
| SMILES | CACTVS | 3.341 | CCO[P](=O)(Cc1ccc(C)cc1)OCC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCOP(=O)(Cc1ccc(cc1)C)OCC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOP(=O)(Cc1ccc(cc1)C)OCC |
| InChI | InChI | 1.03 | InChI=1S/C12H19O3P/c1-4-14-16(13,15-5-2)10-12-8-6-11(3)7-9-12/h6-9H,4-5,10H2,1-3H3 |
| InChIKey | InChI | 1.03 | QKGBKPZAXXBLJE-UHFFFAOYSA-N |
