4-oxo-4-(1H-pyrrol-2-yl)butanoic acid
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4-oxo-4-(1H-pyrrol-2-yl)butanoic acid
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CAS No:
71739-65-6
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Formula:
C8H9NO3
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Chemical Name:
4-oxo-4-(1H-pyrrol-2-yl)butanoic acid
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Synonyms:
4-oxo-4-(1H-pyrrol-2-yl)butanoic acid;71739-65-6;NSC87229;NSC-87229;NCIStruc1_000177;NCIStruc2_000097;CHEMBL1321807;DTXSID50293107;NCI87229;ZINC1561730;CCG-36272;NCGC00013914;AKOS022637376;NCGC00013914-02;NCGC00097023-01;NCI60_041930;Z1982493962
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CAS No:
4-oxo-4-(1H-pyrrol-2-yl)butanoic acid Basic Attributes
167.16 g/mol
167.058243149 g/mol
87229
DTXSID50293107
Computed Properties
Molecular Weight:167.16
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:167.058243149
Monoisotopic Mass:167.058243149
Topological Polar Surface Area:70.2
Heavy Atom Count:12
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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