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1-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

1-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS: 133749-24-3

Formula: C13H15NO5

SMILES: COC1=CC(OC)=C(C=C1)N1CC(CC1=O)C(O)=O

IUPAC: 1-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

InChI: InChI=1/C13H15NO5/c1-18-9-3-4-10(11(6-9)19-2)14-7-8(13(16)17)5-12(14)15/h3-4,6,8H,5,7H2,1-2H3,(H,16,17)

Composition: C (58.86%), H (5.70%), N (5.28%), O (30.16%)

Molar Mass: 265.265

Atom Count: 34

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 265.095022587
Formal Charge 0
FSP3 0.38
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey MXNQXFPGGPZDQK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.94
Topological Polar Surface Area 76.07
Polarizability 25.65
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <10 Days 133749-24-3 $256.11-$398.82$256.11$304.00$351.90$398.82
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95% <2 Days 133749-24-3 $518.71$518.71
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