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Catalog Number | ACM2181842 |
CAS Number | 2181-84-2 |
Synonyms | Isopteleine |
Molecular Weight | 229.23 |
InChI | InChI=1S/C13H11NO3/c1-14-11-4-3-8(16-2)7-10(11)12(15)9-5-6-17-13(9)14/h3-7H,1-2H3 |
InChI Key | XKTZVOMYVJKQTH-UHFFFAOYSA-N |
Melting Point | 210-211 °C |
Purity | 95%+ |
Complexity | 320 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Exact Mass | 229.07389321 |
Heavy Atom Count | 17 |
Hydrogen Bond Acceptor Count | 4 |
Hydrogen Bond Donor Count | 0 |
Monoisotopic Mass | 229.07389321 |
PhysicalState | Powder |
Rotatable Bond Count | 1 |
Topological Polar Surface Area | 42.7 Ų |
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