| CAS Number | 1956356-28-7 |
| Catalog Number | AG00ILC4(AGN-PC-0WNGDH) |
| Chemical Name | Pyrimidin-5-ylmethanamine dihydrochloride |
| IUPAC Name | pyrimidin-5-ylmethanamine;dihydrochloride |
| InChI | InChI=1S/C5H7N3.2ClH/c6-1-5-2-7-4-8-3-5;;/h2-4H,1,6H2;2*1H |
| InChI Key | GGKWSOAZVMALEC-UHFFFAOYSA-N |
| MDL Number | MFCD26954817 |
| Molecular Formula | C5H9Cl2N3 |
| Molecular Weight | 182.0511 |
| SMILES | NCC1=CN=CN=C1.[H]Cl.[H]Cl |
| Synonyms | Pyrimidin-5-ylmethanamine dihydrochloride,
(pyrimidin-5-yl)methanamine dihydrochloride,
1956356-28-7,
1199773-53-9,
C-Pyrimidin-5-yl-methylamine dihydrochloride,
KS-00000SRE,
(Pyrimidin-5-yl)methanamine 2HCl,
MFCD26954817,
DS-8435,
NE63211,
SB10017,
AK164227,
SC-22003,
CS-0053092,
|
| Complexity | 58.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.048g/mol |
| Monoisotopic Mass | 181.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number