| CAS Number | 1046788-71-9 |
| Catalog Number | AG00HADZ(AGN-PC-0WG3RV) |
| Chemical Name | (2R,5S)-1,2,5-Trimethylpiperazine Hydrochloride |
| IUPAC Name | (2R,5S)-1,2,5-trimethylpiperazine;hydrochloride |
| InChI | InChI=1S/C7H16N2.ClH/c1-6-5-9(3)7(2)4-8-6;/h6-8H,4-5H2,1-3H3;1H/t6-,7+;/m0./s1 |
| InChI Key | HTJODMQOZCPIRR-UOERWJHTSA-N |
| MDL Number | MFCD12024513 |
| Molecular Formula | C7H17ClN2 |
| Molecular Weight | 164.6763 |
| SMILES | Cl.CN1[C@@H](CN[C@H](C1)C)C |
| Synonyms | 1046788-71-9,
(2R,5S)-1,2,5-trimethylpiperazine hydrochloride,
(2R,5S)-1,2,5-Trimethylpiperazine HCl,
SCHEMBL3326765,
MFCD12024513,
CS-0037363,
FT-0657450,
(2R,5S)-1,2,5-Trimethylpiperazine;hydrochloride,
1,2,5-trimethylpiperazine,hydrochloride,
|
| Complexity | 92.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.677g/mol |
| Monoisotopic Mass | 164.108g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number