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methyl 7-bromo-4-fluoro-1-benzofuran-5-carboxylate

methyl 7-bromo-4-fluoro-1-benzofuran-5-carboxylate

CAS: 2306264-86-6

Formula: C10H6BrFO3

SMILES: COC(=O)C1=CC(Br)=C2OC=CC2=C1F

IUPAC: methyl 7-bromo-4-fluoro-1-benzofuran-5-carboxylate

InChI: InChI=1S/C10H6BrFO3/c1-14-10(13)6-4-7(11)9-5(8(6)12)2-3-15-9/h2-4H,1H3

Composition: C (43.99%), H (2.21%), Br (29.26%), F (6.96%), O (17.58%)

Molar Mass: 273.057

Atom Count: 21

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 271.948435
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey RJEFKWNAJUKWSS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.76
Topological Polar Surface Area 39.44
Polarizability 21.79
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2306264-86-6 $720.03-$1,136.16$720.03$1,136.16
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