| CAS Number | 954138-59-1 |
| Catalog Number | AG00J2WD(AGN-PC-0WB665) |
| Chemical Name | (S)-1-(Piperazin-1-yl)propan-2-ol dihydrochloride |
| IUPAC Name | (2S)-1-piperazin-1-ylpropan-2-ol |
| InChI | InChI=1S/C7H16N2O/c1-7(10)6-9-4-2-8-3-5-9/h7-8,10H,2-6H2,1H3/t7-/m0/s1 |
| InChI Key | XAKIZRLIXGLPBW-ZETCQYMHSA-N |
| MDL Number | MFCD28891444 |
| Molecular Formula | C7H16N2O |
| Molecular Weight | 144.2147 |
| SMILES | C[C@@H](CN1CCNCC1)O |
| Synonyms | (2S)-1-(piperazin-1-yl)propan-2-ol,
954138-59-1,
SCHEMBL1393824,
ZINC19364553,
AKOS006377397,
NE27255,
AJ-72924,
(2S)-1-(1-Piperazinyl)-2-propanol dihydrochloride,
|
| Complexity | 91.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.218g/mol |
| Monoisotopic Mass | 144.126g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number