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19977-11-8 7-(2-Benzoyloxy-3-(4-(o-chlorobenzyl)-1-piperazinyl)propyl)theophyllin e |
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Chemical Name | 7-(2-Benzoyloxy-3-(4-(o-chlorobenzyl)-1-piperazinyl)propyl)theophyllin e |
Synonyms | 1-Piperazineethanol, 4-(o-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmethyl)-, benzoate (ester);7-(2-Benzoyloxy-3-(4-(o-chlorobenzyl)-1-piperazinyl)propyl)theophylline;BRN 0601417;Theophylline, 7-(2-benzoyloxy-3-(4-(o-chlorobenzyl)-1-piperazinyl)propyl)-;1-[4-(2-chlorobenzyl)piperazin-1-yl]-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propan-2-yl benzoate |
Molecular Formula | C28H31ClN6O4 |
Molecular Weight | 551.0365 |
InChl | InChI=1/C28H31ClN6O4/c1-31-25-24(26(36)32(2)28(31)38)35(19-30-25)18-22(39-27(37)20-8-4-3-5-9-20)17-34-14-12-33(13-15-34)16-21-10-6-7-11-23(21)29/h3-11,19,22H,12-18H2,1-2H3 |
CAS Registry Number | 19977-11-8 |
Molecular Structure | |
Density | 1.36g/cm3 |
Boiling Point | 737.4°C at 760 mmHg |
Refractive Index | 1.662 |
Flash Point | 399.7°C |
Vapour Pressur | 1.32E-21mmHg at 25°C |
MSDS |