DYB
Summary
| Name: | 4-(1,3,2-DIOXABOROLAN-2-YLOXY)BUTAN-1-AMINIUM |
| Formula: | C6 H15 B N O3 |
| Formal charge: | 1 |
| Formula weight: | 159.999 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-(1,3,2-dioxaborolan-2-yloxy)butan-1-aminium |
| OpenEye OEToolkits | 1.5.0 | 4-(1,3,2-dioxaborolan-2-yloxy)butylazanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O(B1OCCO1)CCCC[NH3+] |
| SMILES_CANONICAL | CACTVS | 3.341 | [NH3+]CCCCOB1OCCO1 |
| SMILES | CACTVS | 3.341 | [NH3+]CCCCOB1OCCO1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | B1(OCCO1)OCCCC[NH3+] |
| SMILES | OpenEye OEToolkits | 1.5.0 | B1(OCCO1)OCCCC[NH3+] |
| InChI | InChI | 1.03 | InChI=1S/C6H14BNO3/c8-3-1-2-4-9-7-10-5-6-11-7/h1-6,8H2/p+1 |
| InChIKey | InChI | 1.03 | KTZDASPSWBAPAR-UHFFFAOYSA-O |
