2-[5-acetyl-3-(methoxycarbonyl)-4-methyl-1h-pyrrol-2-yl]acetic acid

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CAS867329-95-1
Purity%
Product CodeF652633
Product Name2-[5-acetyl-3-(methoxycarbonyl)-4-methyl-1h-pyrrol-2-yl]acetic acid
CAS867329-95-1
Purity95%
Molecular weight239.227
IUPAC Name2-[5-acetyl-3-(methoxycarbonyl)-4-methyl-1H-pyrrol-2-yl]acetic acid
SMILESCOC(=O)C1=C(CC(O)=O)NC(C(C)=O)=C1C
INCHI CodeInChI=1S/C11H13NO5/c1-5-9(11(16)17-3)7(4-8(14)15)12-10(5)6(2)13/h12H,4H2,1-3H3,(H,14,15)
Asymmetric atoms0
LogP0.6054263
H bond acceptors4
H bond donors2
fsp30.36363637
Concept CodesKetone, Carboxylic acid, Ester, Heterocycle, Heteroaromatic, Methyl, 5-Membered heteroaromatic, 5-Membered heterocycle, Pyrrole, Cyclic, Aromatic