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Catalog | BBC23316678 |
CAS | 23316-67-8 |
Structure | ![]() |
Synonyms | D-Allononitrile, 2,5-anhydro-, 3,4,6-tribenzoate |
IUPAC Name | [(2R,3R,4S,5S)-3,4-dibenzoyloxy-5-cyanooxolan-2-yl]methyl benzoate |
Molecular Weight | 471.47 |
Molecular Formula | C27H21NO7 |
Canonical SMILES | C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)C#N)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
InChI | InChI=1S/C27H21NO7/c28-16-21-23(34-26(30)19-12-6-2-7-13-19)24(35-27(31)20-14-8-3-9-15-20)22(33-21)17-32-25(29)18-10-4-1-5-11-18/h1-15,21-24H,17H2/t21-,22+,23-,24+/m0/s1 |
InChI Key | OFMYTVNDIRTGMR-UARRHKHWSA-N |
Boiling Point | 643.1±55.0 °C |
Melting Point | 65-75 °C |
Purity | 98% |
Density | 1.35±0.1 g/ml |
Appearance | Light brown to brown solid |
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