| CAS Number | 71777-64-5 |
| Catalog Number | AG00IC72 |
| Chemical Name | 1-(5-methylpyridin-2-yl)ethanol |
| IUPAC Name | 1-(5-methylpyridin-2-yl)ethanol |
| InChI | InChI=1S/C8H11NO/c1-6-3-4-8(7(2)10)9-5-6/h3-5,7,10H,1-2H3 |
| InChI Key | AFOKUYZVCAVTHF-UHFFFAOYSA-N |
| MDL Number | MFCD16620343 |
| Molecular Formula | C8H11NO |
| Molecular Weight | 137.1790 |
| SMILES | CC(C1=NC=C(C)C=C1)O |
| Synonyms | 1-(5-methylpyridin-2-yl)ethanol,
71777-64-5,
2-Pyridinemethanol, alpha,5-dimethyl-,
SCHEMBL11697158,
1-(5-methylpyridin-2-yl)ethan-1-ol,
AKOS017515991,
AS-44863,
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| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.084064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.18g/mol |
| Monoisotopic Mass | 137.084064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.1Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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