ZPM
Summary
Name: | cyclobutanecarboxylic acid |
Formula: | C5 H8 O2 |
Formal charge: | 0 |
Formula weight: | 100.116 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | cyclobutanecarboxylic acid |
OpenEye OEToolkits | 2.0.7 | cyclobutanecarboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C1CCC1 |
InChI | InChI | 1.03 | InChI=1S/C5H8O2/c6-5(7)4-2-1-3-4/h4H,1-3H2,(H,6,7) |
InChIKey | InChI | 1.03 | TXWOGHSRPAYOML-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C1CCC1 |
SMILES | CACTVS | 3.385 | OC(=O)C1CCC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CC(C1)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CC(C1)C(=O)O |