| CAS Number | 1648864-47-4 |
| Catalog Number | AG01DILB(AGN-PC-0WCMYS) |
| Chemical Name | Methyl 2-(2-chloro-4-(6-methylpyridin-2-yl)phenyl)acetate |
| IUPAC Name | methyl 2-[2-chloro-4-(6-methylpyridin-2-yl)phenyl]acetate |
| InChI | InChI=1S/C15H14ClNO2/c1-10-4-3-5-14(17-10)12-7-6-11(13(16)8-12)9-15(18)19-2/h3-8H,9H2,1-2H3 |
| InChI Key | OBVSWFLAZQLFEG-UHFFFAOYSA-N |
| MDL Number | MFCD28506247 |
| Molecular Formula | C15H14ClNO2 |
| Molecular Weight | 275.7302 |
| SMILES | O=C(OC)CC1=CC=C(C2=NC(C)=CC=C2)C=C1Cl |
| Synonyms | methyl 2-(2-chloro-4-(6-methylpyridin-2-yl)phenyl)acetate,
1648864-47-4,
SCHEMBL16414633,
OBVSWFLAZQLFEG-UHFFFAOYSA-N,
MFCD28506247,
ZINC263624172,
AS-48582,
|
| Complexity | 311 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.732g/mol |
| Monoisotopic Mass | 275.071g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number