3H0
Summary
Name: | propylbenzene |
Formula: | C9 H12 |
Formal charge: | 0 |
Formula weight: | 120.192 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | propylbenzene |
OpenEye OEToolkits | 1.9.2 | propylbenzene |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1ccccc1CCC |
InChI | InChI | 1.03 | InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3 |
InChIKey | InChI | 1.03 | ODLMAHJVESYWTB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCc1ccccc1 |
SMILES | CACTVS | 3.385 | CCCc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCCc1ccccc1 |
SMILES | OpenEye OEToolkits | 1.9.2 | CCCc1ccccc1 |