| CAS Number | 97846-32-7 |
| Catalog Number | AG01A71T(AGN-PC-0W7K5N) |
| Chemical Name | Pyrimidine-4,5-diamine hydrochloride |
| IUPAC Name | pyrimidine-4,5-diamine;hydrochloride |
| InChI | InChI=1S/C4H6N4.ClH/c5-3-1-7-2-8-4(3)6;/h1-2H,5H2,(H2,6,7,8);1H |
| InChI Key | HXBNENHPZIJFTQ-UHFFFAOYSA-N |
| MDL Number | MFCD27500670 |
| Molecular Formula | C4H7ClN4 |
| Molecular Weight | 146.5782 |
| SMILES | NC1=NC=NC=C1N.[H]Cl |
| Synonyms | Pyrimidine-4,5-diamine hydrochloride,
63211-97-2,
97846-32-7,
SCHEMBL10869221,
CTK1I7849,
DTXSID10608758,
HXBNENHPZIJFTQ-UHFFFAOYSA-N,
4,5-diaminopyrimidine hydrochloride,
4,5-diamino-pyrimidine hydrochloride,
4,5-Pyrimidinediamine, hydrochloride,
MFCD27500670,
Pyrimidine-4,5-diamine--hydrogen chloride (1/1),
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| Complexity | 74.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.578g/mol |
| Monoisotopic Mass | 146.036g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 77.8A^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