(4-nitrophenyl)methyl (2S)-2-(1,3-dioxoisoindol-2-yl)-6-oxohexanoate
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(4-nitrophenyl)methyl (2S)-2-(1,3-dioxoisoindol-2-yl)-6-oxohexanoate
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CAS No:
121145-63-9
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Formula:
C21H18N2O7
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Chemical Name:
(4-nitrophenyl)methyl (2S)-2-(1,3-dioxoisoindol-2-yl)-6-oxohexanoate
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Synonyms:
PH-ALL-NBE;phthalyl-allysine-4-nitrobenzyl ester;Phthalyl-allysine-4-nitrobenzyl ester;121145-63-9;PH-All-nbe;DTXSID20153168
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CAS No:
(4-nitrophenyl)methyl (2S)-2-(1,3-dioxoisoindol-2-yl)-6-oxohexanoate Basic Attributes
410.4 g/mol
410.11140092 g/mol
DTXSID20153168
Computed Properties
Molecular Weight:410.4
XLogP3:2.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:410.11140092
Monoisotopic Mass:410.11140092
Topological Polar Surface Area:127
Heavy Atom Count:30
Complexity:657
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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