3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate
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3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate
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CAS No:
129799-11-7
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Formula:
C14H18N2O4
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Chemical Name:
3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate
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Synonyms:
1,3-Piperazinedicarboxylic acid,3-methyl 1-(phenylmethyl) ester;3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate;Methyl 4-(benzyloxycarbonyl)piperazine-2-carboxylate;1-Benzyl 3-methyl piperazine-1,3-dicarboxylate;1-O-Benzyl 3-O-methyl piperazine-1,3-dicarboxylate
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CAS No:
3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate Basic Attributes
278.3
278.30
DTXSID90373871
2933599090
Characteristics
67.9
0.9
1.212±0.06 g/cm3(Predicted)
406.5±45.0 °C(Predicted)
199.7±28.7 °C
1.538
1.88E-09mmHg at 25°C
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:278.30
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:278.12665706
Monoisotopic Mass:278.12665706
Topological Polar Surface Area:67.9
Heavy Atom Count:20
Complexity:342
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate
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