| CAS Number | 1255531-13-5 |
| Catalog Number | AG01DKT6 |
| Chemical Name | 2-(Azetidin-3-yl)pyrimidine hydrochloride |
| IUPAC Name | 2-(azetidin-3-yl)pyrimidine;hydrochloride |
| InChI | InChI=1S/C7H9N3.ClH/c1-2-9-7(10-3-1)6-4-8-5-6;/h1-3,6,8H,4-5H2;1H |
| InChI Key | KSRKVXZNSXUWFA-UHFFFAOYSA-N |
| MDL Number | MFCD19980669 |
| Molecular Formula | C7H10ClN3 |
| Molecular Weight | 171.6274 |
| SMILES | Cl.N1CC(C1)C1=NC=CC=N1 |
| Synonyms | 2-(azetidin-3-yl)pyrimidine hydrochloride,
2-(AZETIDIN-3-YL)PYRIMIDINE HCL,
1255531-13-5,
1255306-29-6,
SCHEMBL3723770,
MFCD19980669,
AS-43202,
CS-0029549,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.628g/mol |
| Monoisotopic Mass | 171.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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