| CAS Number | 857237-50-4 |
| Catalog Number | AG004YN2(AGN-PC-0WB3LP) |
| Chemical Name | 3-(4-Methylpiperidin-1-YL)propan-1-OL |
| IUPAC Name | 3-(4-methylpiperidin-1-yl)propan-1-ol |
| InChI | InChI=1S/C9H19NO/c1-9-3-6-10(7-4-9)5-2-8-11/h9,11H,2-8H2,1H3 |
| InChI Key | RFSWWKLQLYHXAB-UHFFFAOYSA-N |
| MDL Number | MFCD08059961 |
| Molecular Formula | C9H19NO |
| Molecular Weight | 157.2533 |
| SMILES | N1(CCCO)CCC(CC1)C |
| Synonyms | 3-(4-METHYLPIPERIDIN-1-YL)PROPAN-1-OL,
857237-50-4,
SCHEMBL91688,
CTK5F5636,
DTXSID00569445,
MFCD08059961,
ZINC15635593,
AKOS009033785,
3-(4-Methyl-1-piperidinyl)-1-propanol,
AJ-67723,
DA-02592,
FT-0732337,
Y-3514,
|
| Complexity | 97.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.257g/mol |
| Monoisotopic Mass | 157.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H315-H319
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number