4-O-(cyanomethyl) 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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4-O-(cyanomethyl) 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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CAS No:
745806-73-9
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Formula:
C12H14N2O4
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Chemical Name:
4-O-(cyanomethyl) 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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Synonyms:
ZINC2646986;AKOS033432429;MCULE-6074600837;NCGC00335098-01;AB01327298-02;Z15670487;4-cyanomethyl 2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate;745806-73-9
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CAS No:
4-O-(cyanomethyl) 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Basic Attributes
250.25 g/mol
250.09535693 g/mol
Computed Properties
Molecular Weight:250.25
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:250.09535693
Monoisotopic Mass:250.09535693
Topological Polar Surface Area:92.2
Heavy Atom Count:18
Complexity:374
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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