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3-[(4-methoxyphenyl)carbamoyl]-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid

3-[(4-methoxyphenyl)carbamoyl]-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid

Formula: C19H23NO4

SMILES: COC1=CC=C(NC(=O)C2C3CCC(C2C(O)=O)C3=C(C)C)C=C1

IUPAC: 3-[(4-methoxyphenyl)carbamoyl]-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid

InChI: InChI=1/C19H23NO4/c1-10(2)15-13-8-9-14(15)17(19(22)23)16(13)18(21)20-11-4-6-12(24-3)7-5-11/h4-7,13-14,16-17H,8-9H2,1-3H3,(H,20,21)(H,22,23)

Composition: C (69.28%), H (7.04%), N (4.25%), O (19.43%)

Molar Mass: 329.396

Atom Count: 47

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 329.162708225
Formal Charge 0
FSP3 0.47
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey QATVGGIXWPARHL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.8
Topological Polar Surface Area 75.63
Polarizability 34.96
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H23NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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