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methyl 2-{[1,1'-biphenyl]-4-amido}benzoate

methyl 2-{[1,1'-biphenyl]-4-amido}benzoate

Formula: C21H17NO3

SMILES: COC(=O)C1=CC=CC=C1NC(=O)C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: methyl 2-{[1,1'-biphenyl]-4-amido}benzoate

InChI: InChI=1S/C21H17NO3/c1-25-21(24)18-9-5-6-10-19(18)22-20(23)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-14H,1H3,(H,22,23)

Composition: C (76.12%), H (5.17%), N (4.23%), O (14.48%)

Molar Mass: 331.371

Atom Count: 42

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 331.120843411
Formal Charge 0
FSP3 0.05
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VESBIKBFVPZGFZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 98.75
Topological Polar Surface Area 55.4
Polarizability 38.33
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H17NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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