5VQ
Summary
Name: | 2-Propen-1-ol |
Synonyms: | allyl alcohol |
Formula: | C3 H6 O |
Formal charge: | 0 |
Formula weight: | 58.079 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.4 | prop-2-en-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2 |
InChIKey | InChI | 1.03 | XXROGKLTLUQVRX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OCC=C |
SMILES | CACTVS | 3.385 | OCC=C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C=CCO |
SMILES | OpenEye OEToolkits | 2.0.4 | C=CCO |