0IF
Summary
Name: | 2-amino-6-fluorobenzonitrile |
Formula: | C7 H5 F N2 |
Formal charge: | 0 |
Formula weight: | 136.126 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-amino-6-fluorobenzonitrile |
OpenEye OEToolkits | 2.0.7 | 2-azanyl-6-fluoranyl-benzenecarbonitrile |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N#Cc1c(F)cccc1N |
InChI | InChI | 1.06 | InChI=1S/C7H5FN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,10H2 |
InChIKey | InChI | 1.06 | IQUNZGOZUJITBJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1cccc(F)c1C#N |
SMILES | CACTVS | 3.385 | Nc1cccc(F)c1C#N |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)F)C#N)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)F)C#N)N |