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AA-516/30012033 is available in 15155 mg

Compound details
MDL #:		MFCD00463473
Formula:		C9 H10 N2 O2 S
Weight:		210.26
Chiral info:		Not available
Name:		ethyl 5-amino-4-cyano-3-methyl-2-thiophenecarboxylate
SMILES:		CCOC(=O)c1c(C)c(C#N)c(N)s1
InChI^TM:		InChI=1S/C9H10N2O2S/c1-3-13-9(12)7-5(2)6(4-10)8(11)14-7/h3,11H2,1-2H3
InChIKey^TM:		NCCMCRFYSZRBBG-UHFFFAOYSA-N

Chemical properties calculations
LogP:	1.87	H-acceptors: 4
LogS:	-2.59	H-donors: 1
tPSA:	104.35 Å²	Rotatable bonds: 3

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