| CAS Number | 194151-94-5 |
| Catalog Number | AG00BB7U(AGN-PC-02IK77) |
| Chemical Name | (2-isopropylpyridin-3-yl)methanol |
| IUPAC Name | (2-propan-2-ylpyridin-3-yl)methanol |
| InChI | InChI=1S/C9H13NO/c1-7(2)9-8(6-11)4-3-5-10-9/h3-5,7,11H,6H2,1-2H3 |
| InChI Key | OCWUXGVRLMGZRE-UHFFFAOYSA-N |
| MDL Number | MFCD18819098 |
| Molecular Formula | C9H13NO |
| Molecular Weight | 151.2056 |
| SMILES | CC(C)C1=C(C=CC=N1)CO |
| Synonyms | (2-isopropylpyridin-3-yl)methanol,
194151-94-5,
2-isopropyl-3-hydroxymethylpyridine,
[2-(propan-2-yl)pyridin-3-yl]methanol,
SCHEMBL5109205,
OCWUXGVRLMGZRE-UHFFFAOYSA-N,
ZINC39103050,
AKOS027401716,
3-pyridinemethanol,2-(1-methylethyl)-,
DA-08681,
FT-0748392,
3-Pyridinemethanol,2-(1-methylethyl)-(9CI),
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.209g/mol |
| Monoisotopic Mass | 151.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number