| CAS Number | 55306-66-6 |
| Catalog Number | AG00DJ7D(AGN-PC-0WANGI) |
| Chemical Name | 4-Chloro-2,6-pyridinedicarbonitrile |
| IUPAC Name | 4-chloropyridine-2,6-dicarbonitrile |
| InChI | InChI=1S/C7H2ClN3/c8-5-1-6(3-9)11-7(2-5)4-10/h1-2H |
| InChI Key | OQBWVPUACGCUCO-UHFFFAOYSA-N |
| MDL Number | MFCD00185811 |
| Molecular Formula | C7H2ClN3 |
| Molecular Weight | 163.5639 |
| SMILES | N#CC1=NC(C#N)=CC(Cl)=C1 |
| Synonyms | 4-Chloropyridine-2,6-dicarbonitrile,
55306-66-6,
4-chloro-2,6-Pyridinedicarbonitrile,
2,6-Pyridinedicarbonitrile, 4-chloro-,
AK164201,
SCHEMBL17866651,
ZINC390791,
KS-00000SR9,
MFCD00185811,
AKOS025146940,
DS-8430,
FCH1158751,
SC-70777,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.564g/mol |
| Monoisotopic Mass | 162.994g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 60.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H302+H312-H315-H319-H331-H335
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P280-P305+P351+P338-P311
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number