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2-[2-(4-chlorophenoxy)acetamido]-4,5-dimethoxybenzoic acid

2-[2-(4-chlorophenoxy)acetamido]-4,5-dimethoxybenzoic acid

Formula: C17H16ClNO6

SMILES: COC1=CC(NC(=O)COC2=CC=C(Cl)C=C2)=C(C=C1OC)C(O)=O

IUPAC: 2-[2-(4-chlorophenoxy)acetamido]-4,5-dimethoxybenzoic acid

InChI: InChI=1S/C17H16ClNO6/c1-23-14-7-12(17(21)22)13(8-15(14)24-2)19-16(20)9-25-11-5-3-10(18)4-6-11/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)

Composition: C (55.82%), H (4.41%), Cl (9.69%), N (3.83%), O (26.24%)

Molar Mass: 365.77

Atom Count: 41

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 365.0666149
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey PECUVDNPGKYGLZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.87
Topological Polar Surface Area 94.09
Polarizability 34.83
Ring Count 2
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H16ClNO6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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