5-nitro-2-pyrrolidin-1-ylbenzoic acid
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5-nitro-2-pyrrolidin-1-ylbenzoic acid
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CAS No:
19555-48-7
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Formula:
C11H12N2O4
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Chemical Name:
5-nitro-2-pyrrolidin-1-ylbenzoic acid
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Synonyms:
5-nitro-2-pyrrolidino-benzoic acid; 5-nitro-2-pyrrolidinylbenzoic acid; 5-nitro-2-pyrrolidin-1-yl-benzoic Acid;
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CAS No:
5-nitro-2-pyrrolidin-1-ylbenzoic acid Basic Attributes
236.22400
236.07970687
DTXSID60369382
2933990090
Characteristics
86.36000
2.48140
1.403 g/cm33
220ºC
446.4ºC at 760 mmHg
223.8ºC
9.44E-09mmHg at 25°C
Computed Properties
Molecular Weight:236.22
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:236.07970687
Monoisotopic Mass:236.07970687
Topological Polar Surface Area:86.4
Heavy Atom Count:17
Complexity:309
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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