| CAS Number | 1248614-20-1 |
| Catalog Number | AG00A02Y |
| Chemical Name | 3-(Chloromethyl)-2-isopropoxypyridine |
| IUPAC Name | 3-(chloromethyl)-2-propan-2-yloxypyridine |
| InChI | InChI=1S/C9H12ClNO/c1-7(2)12-9-8(6-10)4-3-5-11-9/h3-5,7H,6H2,1-2H3 |
| InChI Key | JMFOYBFHPLLXLF-UHFFFAOYSA-N |
| MDL Number | MFCD14607210 |
| Molecular Formula | C9H12ClNO |
| Molecular Weight | 185.6507 |
| SMILES | ClCC=1C(=NC=CC1)OC(C)C |
| Synonyms | 3-(CHLOROMETHYL)-2-ISOPROPOXYPYRIDINE,
1248614-20-1,
DTXSID20734158,
MFCD14607210,
ZINC40886337,
AKOS010519200,
AS-30620,
3-(chloromethyl)-2-propan-2-yloxypyridine,
AB0070960,
FT-0709555,
3-(Chloromethyl)-2-[(propan-2-yl)oxy]pyridine,
3-(chloromethyl)-2-isopropoxypyridine, 95% - 1G 1g,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.651g/mol |
| Monoisotopic Mass | 185.061g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number