5OZ
Summary
Name: | 2-methylpropanal |
Synonyms: | Isobutyraldehyde |
Formula: | C4 H8 O |
Formal charge: | 0 |
Formula weight: | 72.106 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.4 | 2-methylpropanal |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C4H8O/c1-4(2)3-5/h3-4H,1-2H3 |
InChIKey | InChI | 1.03 | AMIMRNSIRUDHCM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(C)C=O |
SMILES | CACTVS | 3.385 | CC(C)C=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CC(C)C=O |
SMILES | OpenEye OEToolkits | 2.0.4 | CC(C)C=O |