| CAS Number | 25514-24-3 |
| Catalog Number | AG01AAP0(AGN-PC-044E6R) |
| Chemical Name | 1-(3-Hydroxypropyl)-1,2-dihydropyridin-2-one |
| IUPAC Name | 1-(3-hydroxypropyl)pyridin-2-one |
| InChI | InChI=1S/C8H11NO2/c10-7-3-6-9-5-2-1-4-8(9)11/h1-2,4-5,10H,3,6-7H2 |
| InChI Key | QLAGPCJUAFNZGR-UHFFFAOYSA-N |
| MDL Number | MFCD12186768 |
| Molecular Formula | C8H11NO2 |
| Molecular Weight | 153.1784 |
| SMILES | OCCCN1C(=O)C=CC=C1 |
| Synonyms | 1-(3-hydroxypropyl)-1,2-dihydropyridin-2-one,
25514-24-3,
1-(3-hydroxy-propyl)-1H-pyridin-2-one,
AC1Q7CSO,
SCHEMBL6536824,
QLAGPCJUAFNZGR-UHFFFAOYSA-N,
ZINC35650048,
AKOS009560824,
MCULE-7747221936,
NE41644,
1-(3-hydroxypropyl) 1,2dihyro-2-pyridone,
1-(3-hydroxypropyl)-1,2dihyro-2-pyridone,
1-(3-hydroxypropyl)-1,2-dihydro-2-pyridone,
1-(3-hydroxypropyl)-1,2dihydro-2- pyridone,
EN300-69207,
Z431366470,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.181g/mol |
| Monoisotopic Mass | 153.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number