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2-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]benzoic acid

2-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]benzoic acid

Formula: C16H14ClNO5

SMILES: COC1=CC(Cl)=C(OC)C=C1NC(=O)C1=CC=CC=C1C(O)=O

IUPAC: 2-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]benzoic acid

InChI: InChI=1S/C16H14ClNO5/c1-22-13-8-12(14(23-2)7-11(13)17)18-15(19)9-5-3-4-6-10(9)16(20)21/h3-8H,1-2H3,(H,18,19)(H,20,21)

Composition: C (57.24%), H (4.20%), Cl (10.56%), N (4.17%), O (23.83%)

Molar Mass: 335.74

Atom Count: 37

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 335.0560503
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey FPECEUKBQBMQAU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.58
Topological Polar Surface Area 84.86
Polarizability 32.28
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H14ClNO5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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