| CAS Number | 149879-32-3 |
| Catalog Number | AG00IZ95(AGN-PC-023KBW) |
| Chemical Name | 5-Benzyl-2-chloropyridine |
| IUPAC Name | 5-benzyl-2-chloropyridine |
| InChI | InChI=1S/C12H10ClN/c13-12-7-6-11(9-14-12)8-10-4-2-1-3-5-10/h1-7,9H,8H2 |
| InChI Key | SFSNZWOWXYUDIO-UHFFFAOYSA-N |
| MDL Number | MFCD22126098 |
| Molecular Formula | C12H10ClN |
| Molecular Weight | 203.6675 |
| SMILES | C1=CC=C(C=C1)CC2=CN=C(C=C2)Cl |
| Synonyms | 5-benzyl-2-chloropyridine,
149879-32-3,
2-Chloro-5-benzylpyridine,
SCHEMBL7784836,
MFCD22126098,
ZINC72190662,
AKOS015991238,
AG-0717,
MCULE-5015578531,
SY246152,
KS-00002247,
MFCD22126098 (97%),
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.669g/mol |
| Monoisotopic Mass | 203.05g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number