1KA
Summary
Name: | (2-hydroxyethoxy)acetaldehyde |
Formula: | C4 H8 O3 |
Formal charge: | 0 |
Formula weight: | 104.105 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2-hydroxyethoxy)acetaldehyde |
OpenEye OEToolkits | 1.7.6 | 2-(2-hydroxyethyloxy)ethanal |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=CCOCCO |
InChI | InChI | 1.03 | InChI=1S/C4H8O3/c5-1-3-7-4-2-6/h1,6H,2-4H2 |
InChIKey | InChI | 1.03 | DSGGHBUAHUMMHN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | OCCOCC=O |
SMILES | CACTVS | 3.370 | OCCOCC=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(COCC=O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(COCC=O)O |