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ethyl 3-(2-chloroacetamido)-4-hydroxybenzoate

ethyl 3-(2-chloroacetamido)-4-hydroxybenzoate

Formula: C11H12ClNO4

SMILES: CCOC(=O)C1=CC=C(O)C(NC(=O)CCl)=C1

IUPAC: ethyl 3-(2-chloroacetamido)-4-hydroxybenzoate

InChI: InChI=1S/C11H12ClNO4/c1-2-17-11(16)7-3-4-9(14)8(5-7)13-10(15)6-12/h3-5,14H,2,6H2,1H3,(H,13,15)

Composition: C (51.28%), H (4.69%), Cl (13.76%), N (5.44%), O (24.84%)

Molar Mass: 257.67

Atom Count: 29

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 257.0454856
Formal Charge 0
FSP3 0.27
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey BNOJCASUIXJSBV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.43
Topological Polar Surface Area 75.63
Polarizability 24.02
Ring Count 1
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H12ClNO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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