| CAS Number | 1782058-56-3 |
| Catalog Number | AG01BI4F |
| Chemical Name | 1-(Pyrimidin-2-yl)cyclobutan-1-amine |
| IUPAC Name | 1-pyrimidin-2-ylcyclobutan-1-amine |
| InChI | InChI=1S/C8H11N3/c9-8(3-1-4-8)7-10-5-2-6-11-7/h2,5-6H,1,3-4,9H2 |
| InChI Key | VVWPMXBUUVPLDO-UHFFFAOYSA-N |
| MDL Number | MFCD28645540 |
| Molecular Formula | C8H11N3 |
| Molecular Weight | 149.193 |
| SMILES | NC1(C2=NC=CC=N2)CCC1 |
| Synonyms | 1-(pyrimidin-2-yl)cyclobutan-1-amine,
1782058-56-3,
SCHEMBL19385802,
ZINC213459792,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.197g/mol |
| Monoisotopic Mass | 149.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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Certificate of Analysis
Lot Number