| CAS Number | 1649468-09-6 |
| Catalog Number | AG01DVSW |
| Chemical Name | 2-(6-Chloropyridin-3-yl)-2-methylpropan-1-ol |
| IUPAC Name | 2-(6-chloropyridin-3-yl)-2-methylpropan-1-ol |
| InChI | InChI=1S/C9H12ClNO/c1-9(2,6-12)7-3-4-8(10)11-5-7/h3-5,12H,6H2,1-2H3 |
| InChI Key | DVNUXKZFBPFRJU-UHFFFAOYSA-N |
| MDL Number | MFCD28468766 |
| Molecular Formula | C9H12ClNO |
| Molecular Weight | 185.6507 |
| SMILES | CC(C)(C1=CC=C(Cl)N=C1)CO |
| Synonyms | 2-(6-chloropyridin-3-yl)-2-methylpropan-1-ol,
SCHEMBL9685382,
DVNUXKZFBPFRJU-UHFFFAOYSA-N,
ZINC146085589,
1649468-09-6,
2-(6-chloro-pyrid-3-yl)-2-methylpropanol,
2-(6-Chloro-pyrid-3-yl)-2-methyl-propanol,
|
| Complexity | 150 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.651g/mol |
| Monoisotopic Mass | 185.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number