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ethyl 2-[(4-bromophenyl)carbamoyl]-3-phenylpropanoate

ethyl 2-[(4-bromophenyl)carbamoyl]-3-phenylpropanoate

Formula: C18H18BrNO3

SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)NC1=CC=C(Br)C=C1

IUPAC: ethyl 2-[(4-bromophenyl)carbamoyl]-3-phenylpropanoate

InChI: InChI=1/C18H18BrNO3/c1-2-23-18(22)16(12-13-6-4-3-5-7-13)17(21)20-15-10-8-14(19)9-11-15/h3-11,16H,2,12H2,1H3,(H,20,21)

Composition: C (57.46%), H (4.82%), Br (21.24%), N (3.72%), O (12.76%)

Molar Mass: 376.25

Atom Count: 41

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 375.047006
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZSVUCFJXRPTPSR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.68
Topological Polar Surface Area 55.4
Polarizability 35.68
Ring Count 2
Rotatable Bond Count 7

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H18BrNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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