| CAS Number | 1233951-96-6 |
| Catalog Number | AG01C35R |
| Chemical Name | 1-Methyl-3-(piperidin-4-yl)urea hydrochloride |
| IUPAC Name | 1-methyl-3-piperidin-4-ylurea;hydrochloride |
| InChI | InChI=1S/C7H15N3O.ClH/c1-8-7(11)10-6-2-4-9-5-3-6;/h6,9H,2-5H2,1H3,(H2,8,10,11);1H |
| InChI Key | SEHYRPWWVZJGAG-UHFFFAOYSA-N |
| MDL Number | MFCD17014311 |
| Molecular Formula | C7H16ClN3O |
| Molecular Weight | 193.6744 |
| SMILES | Cl.CNC(NC1CCNCC1)=O |
| Synonyms | 1-Methyl-3-(piperidin-4-yl)urea hydrochloride,
1233951-96-6,
3-methyl-1-(piperidin-4-yl)urea hydrochloride,
AKOS026671606,
KS-5979,
A1-01579,
Z2327226098,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.675g/mol |
| Monoisotopic Mass | 193.098g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number