Arenaine
(4S,4aS)-1-amino-7-ethenyl-4,7-dimethyl-4,4a,5,6-tetrahydropyrrolo[1,2-c]pyrimidin-3-one
Also Known As: Arenaine|(4S,4aS)-1-amino-7-ethenyl-4,7-dimethyl-4,4a,5,6-tetrahydropyrrolo[1,2-c]pyrimidin-3-one|(4S,4aS)-1-amino-4,7-dimethyl-7-vinyl-4,4a,5,6-tetrahydropyrrolo[1,2-c]pyrimidin-3-one|(4S,4aS)-1-amino-4,7-dimethyl-7-vinyl-4,4a,5,6-tetrahydropyrrolo(1,2-c)pyrimidin-3-one|(4S,4aS)-1-Amino-7-ethenyl-4,7-dimethyl-4a,5,6,7-tetrahydropyrrolo[1,2-c]pyrimidin-3(4H)-one
| Molecular Formula | C11H17N3O |
|---|---|
| Molecular Weight | 207.13716 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.13716 |
| Monoisotopic Mass | 207.13716 |
| Heavy Atoms | 15 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 35471-10-4 |
|---|---|
| SMILES | C[C@H]1[C@@H]2CCC(N2C(=NC1=O)N)(C)C=C |
| InChIKey | JICZMZVYTMAXGX-KHSUWTBESA-N |
Product Overview
Arenaine (CAS 35471-10-4), with molecular formula C11H17N3O and molecular weight 207.13716 g/mol. IUPAC: (4S,4aS)-1-amino-7-ethenyl-4,7-dimethyl-4,4a,5,6-tetrahydropyrrolo[1,2-c]pyrimidin-3-one.
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