9CL
Summary
Name: | (chloromethyl)benzene |
Formula: | C7 H7 Cl |
Formal charge: | 0 |
Formula weight: | 126.583 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (chloromethyl)benzene |
OpenEye OEToolkits | 1.7.0 | chloromethylbenzene |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | ClCc1ccccc1 |
SMILES_CANONICAL | CACTVS | 3.370 | ClCc1ccccc1 |
SMILES | CACTVS | 3.370 | ClCc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CCl |
SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CCl |
InChI | InChI | 1.03 | InChI=1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2 |
InChIKey | InChI | 1.03 | KCXMKQUNVWSEMD-UHFFFAOYSA-N |