1H-Pyrrole-2,5-dicarboxylic acid, 2,5-dimethyl ester
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1H-Pyrrole-2,5-dicarboxylic acid, 2,5-dimethyl ester
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CAS No:
1757-29-5
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Formula:
C8H9NO4
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Chemical Name:
1H-Pyrrole-2,5-dicarboxylic acid, 2,5-dimethyl ester
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Synonyms:
1H-Pyrrole-2,5-dicarboxylic acid,2,5-dimethyl ester;Pyrrole-2,5-dicarboxylic acid,dimethyl ester;1H-Pyrrole-2,5-dicarboxylic acid,dimethyl ester;Dimethyl 1H-pyrrole-2,5-dicarboxylate;2,5-Dimethyl 1H-pyrrole-2,5-dicarboxylate
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CAS No:
Characteristics
68.39000
0.58790
1.276±0.06 g/cm3
132 °C @ Solvent: Water
310.7±22.0 °C(Predicted)
13.32±0.50
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:183.16
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:183.05315777
Monoisotopic Mass:183.05315777
Topological Polar Surface Area:68.4
Heavy Atom Count:13
Complexity:194
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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