| CAS Number | 1429056-39-2 |
| Catalog Number | AG009WJG(AGN-PC-0WAMXC) |
| Chemical Name | 5-(Piperazin-1-yl)pyrimidine hydrochloride |
| IUPAC Name | 5-piperazin-1-ylpyrimidine;hydrochloride |
| InChI | InChI=1S/C8H12N4.ClH/c1-3-12(4-2-9-1)8-5-10-7-11-6-8;/h5-7,9H,1-4H2;1H |
| InChI Key | YBETUEKOSIAOLN-UHFFFAOYSA-N |
| MDL Number | MFCD23141003 |
| Molecular Formula | C8H13ClN4 |
| Molecular Weight | 200.6686 |
| SMILES | [H]Cl.C1(N2CCNCC2)=CN=CN=C1 |
| Synonyms | 5-(Piperazin-1-yl)pyrimidine hydrochloride,
1429056-39-2,
5-(PIPERAZIN-1-YL)PYRIMIDINE HCL,
634468-92-1,
AK108394,
SCHEMBL4813927,
CTK8C5076,
KS-00000QSL,
ANW-73963,
MFCD23141003,
AKOS016008652,
AS-42005,
AX8240891,
ST2418583,
TC-162708,
Pyrimidine, 5-(1-piperazinyl)-, hydrochloride,
X-3588,
J-007717,
202135-70-4,
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| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.67g/mol |
| Monoisotopic Mass | 200.083g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P280-P305+P351+P338-P310
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UN Code
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Certificate of Analysis
Lot Number