| CAS Number | 1417347-15-9 |
| Catalog Number | AG00J2CH |
| Chemical Name | 2-(1-piperazinyl)propanoic acid dihydrochloride |
| IUPAC Name | 2-piperazin-1-ylpropanoic acid;dihydrochloride |
| InChI | InChI=1S/C7H14N2O2.2ClH/c1-6(7(10)11)9-4-2-8-3-5-9;;/h6,8H,2-5H2,1H3,(H,10,11);2*1H |
| InChI Key | HSBOMMGREWADKV-UHFFFAOYSA-N |
| MDL Number | MFCD03094648 |
| Molecular Formula | C7H16Cl2N2O2 |
| Molecular Weight | 231.1201 |
| SMILES | N1(CCNCC1)C(C)C(O)=O.Cl.Cl |
| Synonyms | 2-(piperazin-1-yl)propanoic acid dihydrochloride,
824414-03-1,
2-(1-PIPERAZINYL)PROPANOIC ACID DIHYDROCHLORIDE,
2-PIPERAZIN-1-YLPROPANOIC ACID DIHYDROCHLORIDE,
1417347-15-9,
SCHEMBL1184615,
ZX-CM009015,
MFCD03094648,
AKOS015893264,
FT-0683180,
R6506,
I04-4679,
rac 2-(Piperazin-1-yl)-propionic acid x 2 H2O,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.117g/mol |
| Monoisotopic Mass | 230.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number