| CAS Number | 1349708-60-6 |
| Catalog Number | AG01DMD9 |
| Chemical Name | 3,4-Dichloro-2-fluorobenzonitrile |
| IUPAC Name | 3,4-dichloro-2-fluorobenzonitrile |
| InChI | InChI=1S/C7H2Cl2FN/c8-5-2-1-4(3-11)7(10)6(5)9/h1-2H |
| InChI Key | ZQUPFWQQQMEVTL-UHFFFAOYSA-N |
| MDL Number | MFCD19686191 |
| Molecular Formula | C7H2Cl2FN |
| Molecular Weight | 190.0019 |
| SMILES | ClC=1C(=C(C#N)C=CC1Cl)F |
| Synonyms | 3,4-Dichloro-2-fluorobenzonitrile,
1349708-60-6,
dichlorofluorobenzonitrile,
SCHEMBL8859185,
MFCD19686191,
ZINC67802848,
FCH1196049,
AS-43950,
AX8277683,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.998g/mol |
| Monoisotopic Mass | 188.955g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number