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AQ-776/42801550 is available in 6 mg

Compound details
MDL #:		MFCD05863424
Formula:		C8 H9 N O4
Weight:		183.16
Chiral info:		Not available
Name:		5-(ethoxycarbonyl)-1H-pyrrole-2-carboxylic acid
SMILES:		CCOC(=O)c1ccc([nH]1)C(O)=O
InChI^TM:		InChI=1S/C8H9NO4/c1-2-13-8(12)6-4-3-5(9-6)7(10)11/h3-4,9H,2H2,1H3,(H,10,11)
InChIKey^TM:		BMQLZHDFXVPFKX-UHFFFAOYSA-N

Chemical properties calculations
LogP:	1.09	H-acceptors: 5
LogS:	-1.47	H-donors: 2
tPSA:	79.39 Å²	Rotatable bonds: 4

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.