| CAS Number | 944899-44-9 |
| Catalog Number | AG00II8K(AGN-PC-0WNOCB) |
| Chemical Name | 2-(2-Cyclopropylpyrimidin-5-yl)ethanamine |
| IUPAC Name | 2-(2-cyclopropylpyrimidin-5-yl)ethanamine |
| InChI | InChI=1S/C9H13N3/c10-4-3-7-5-11-9(12-6-7)8-1-2-8/h5-6,8H,1-4,10H2 |
| InChI Key | UXIICOJHCSNIEL-UHFFFAOYSA-N |
| MDL Number | MFCD10697337 |
| Molecular Formula | C9H13N3 |
| Molecular Weight | 163.2196 |
| SMILES | NCCC1=CN=C(C2CC2)N=C1 |
| Synonyms | 2-(2-CYCLOPROPYLPYRIMIDIN-5-YL)ETHANAMINE,
944899-44-9,
2-(2-cyclopropylpyrimidin-5-yl)ethan-1-amine,
MFCD10697337,
ZINC54857389,
AKOS012051487,
AB59385,
MCULE-2356799748,
L-2229,
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| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.224g/mol |
| Monoisotopic Mass | 163.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
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