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(2Z)-3-[(4-propylphenyl)carbamoyl]prop-2-enoic acid

(2Z)-3-[(4-propylphenyl)carbamoyl]prop-2-enoic acid

Formula: C13H15NO3

SMILES: CCCC1=CC=C(NC(=O)C=C/C(O)=O)C=C1

IUPAC: (2Z)-3-[(4-propylphenyl)carbamoyl]prop-2-enoic acid

InChI: InChI=1S/C13H15NO3/c1-2-3-10-4-6-11(7-5-10)14-12(15)8-9-13(16)17/h4-9H,2-3H2,1H3,(H,14,15)(H,16,17)/b9-8-

Composition: C (66.94%), H (6.48%), N (6.00%), O (20.58%)

Molar Mass: 233.267

Atom Count: 32

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 233.105193347
Formal Charge 0
FSP3 0.23
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GLRHIWBWLCLOKE-HJWRWDBZSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.13
Topological Polar Surface Area 66.4
Polarizability 24.61
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H15NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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