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3-[(4-methoxyphenyl)carbamoyl]propanoic acid

3-[(4-methoxyphenyl)carbamoyl]propanoic acid

Formula: C11H13NO4

SMILES: COC1=CC=C(NC(=O)CCC(O)=O)C=C1

IUPAC: 3-[(4-methoxyphenyl)carbamoyl]propanoic acid

InChI: InChI=1S/C11H13NO4/c1-16-9-4-2-8(3-5-9)12-10(13)6-7-11(14)15/h2-5H,6-7H2,1H3,(H,12,13)(H,14,15)

Composition: C (59.19%), H (5.87%), N (6.27%), O (28.67%)

Molar Mass: 223.228

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 223.084457903
Formal Charge 0
FSP3 0.27
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey SXTDOBIIAISFSI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.28
Topological Polar Surface Area 75.63
Polarizability 21.98
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H13NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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