| CAS Number | 7256-21-5 |
| Catalog Number | AG003TSG(AGN-PC-0U0U38) |
| Chemical Name | Pipecolyldithiocarbamic Acid Pipecolinium Salt |
| IUPAC Name | 2-methylpiperidine;2-methylpiperidine-1-carbodithioic acid |
| InChI | InChI=1S/C7H13NS2.C6H13N/c1-6-4-2-3-5-8(6)7(9)10;1-6-4-2-3-5-7-6/h6H,2-5H2,1H3,(H,9,10);6-7H,2-5H2,1H3 |
| InChI Key | HIZBYGUSYOUVAB-UHFFFAOYSA-N |
| MDL Number | MFCD00135325 |
| Molecular Formula | C13H26N2S2 |
| Molecular Weight | 274.4889 |
| NSC Number | 24200 |
| SMILES | CC1CCCCN1C(=S)S.CC1CCCCN1 |
| Synonyms | 7256-21-5,
2-methylpiperidine-1-carbodithioic acid- 2-methylpiperidine(1:1),
NSC24200,
AC1Q7EPA,
AC1L5IL4,
CTK5D6486,
DTXSID90282095,
NSC-24200,
P0687,
2-methylpiperidine; 2-methylpiperidine-1-carbodithioic acid,
2-Methyl-1-piperidinecarbodithioic Acid - 2-Methylpiperidine Complex,
2-Methylpiperidine-1-carbodithioic acid--2-methylpiperidine (1/1),
Pipecoline Pipecolyldithiocarbamate,
AR-1E4120,
CID230011,
Pipecolyldithiocarbamic Acid Pipecolinium Salt,
2-methylpiperidine;2-methylpiperidine-1-carbodithioic acid,
94221-20-2,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.154g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.485g/mol |
| Monoisotopic Mass | 274.154g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 48.4A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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