| CAS Number | 1341983-10-5 |
| Catalog Number | AG01ANCD |
| Chemical Name | 3-(3-hydroxypropyl)-3,4-dihydropyrimidin-4-one |
| IUPAC Name | 3-(3-hydroxypropyl)pyrimidin-4-one |
| InChI | InChI=1S/C7H10N2O2/c10-5-1-4-9-6-8-3-2-7(9)11/h2-3,6,10H,1,4-5H2 |
| InChI Key | HSLODCRGRKUNTL-UHFFFAOYSA-N |
| MDL Number | MFCD18883849 |
| Molecular Formula | C7H10N2O2 |
| Molecular Weight | 154.1665 |
| SMILES | OCCCN1C(=O)C=CN=C1 |
| Synonyms | 3-(3-hydroxypropyl)-3,4-dihydropyrimidin-4-one,
1341983-10-5,
ZINC82599186,
AKOS013081204,
Z1419507296,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.169g/mol |
| Monoisotopic Mass | 154.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number