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3-[(3,5-dichlorophenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

3-[(3,5-dichlorophenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Formula: C14H11Cl2NO4

SMILES: OC(=O)C1C2OC(C=C2)C1C(=O)NC1=CC(Cl)=CC(Cl)=C1

IUPAC: 3-[(3,5-dichlorophenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

InChI: InChI=1/C14H11Cl2NO4/c15-6-3-7(16)5-8(4-6)17-13(18)11-9-1-2-10(21-9)12(11)14(19)20/h1-5,9-12H,(H,17,18)(H,19,20)

Composition: C (51.24%), H (3.38%), Cl (21.61%), N (4.27%), O (19.50%)

Molar Mass: 328.15

Atom Count: 32

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 327.0065132
Formal Charge 0
FSP3 0.29
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey LPMJXZCKUWKSPX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.3
Topological Polar Surface Area 75.63
Polarizability 29.69
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H11Cl2NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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