[4-(cyanomethyl)-4-hydroxy-6-methoxy-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate
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[4-(cyanomethyl)-4-hydroxy-6-methoxy-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate
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CAS No:
51970-12-8
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Formula:
C23H21N3O11
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Chemical Name:
[4-(cyanomethyl)-4-hydroxy-6-methoxy-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate
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Synonyms:
51970-12-8;NSC294933;DTXSID80315503;NSC-294933;[4-(cyanomethyl)-4-hydroxy-6-methoxy-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate
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CAS No:
[4-(cyanomethyl)-4-hydroxy-6-methoxy-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate Basic Attributes
515.4 g/mol
515.11760849 g/mol
294933
DTXSID80315503
Computed Properties
Molecular Weight:515.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:515.11760849
Monoisotopic Mass:515.11760849
Topological Polar Surface Area:207
Heavy Atom Count:37
Complexity:894
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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