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N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide

N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide

Formula: C17H14BrNO4

SMILES: CC(=O)NC1=CC2=C(OCCO2)C=C1C(=O)C1=CC=CC=C1Br

IUPAC: N-[7-(2-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]acetamide

InChI: InChI=1S/C17H14BrNO4/c1-10(20)19-14-9-16-15(22-6-7-23-16)8-12(14)17(21)11-4-2-3-5-13(11)18/h2-5,8-9H,6-7H2,1H3,(H,19,20)

Composition: C (54.28%), H (3.75%), Br (21.24%), N (3.72%), O (17.01%)

Molar Mass: 376.206

Atom Count: 37

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 375.010621
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey BRLKESIWFJWIOL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 90.08
Topological Polar Surface Area 64.63
Polarizability 34
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 C17H14BrNO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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